SCHEMBL10172753

SCHEMBL10172753

CSc1ccccc1COC(C)=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
L3MBTL1 Q9Y468 5/20 0.60
MAPT P10636 3/20 0.60
LMNA P02545 3/20 0.58
TSHR P16473 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.39
PTGS2 P35354 1/20 0.39
CASP3 P42574 1/20 0.39
HTT P42858 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
NPC1 O15118 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13373592 0.88 L3MBTL1 (0.56) ALDH1A1L3MBTL1MAPTLMNATSHR
SCHEMBL19564949 0.86 MAPT (0.50) ALDH1A1L3MBTL1MAPTLMNACYP1A2
SCHEMBL16490234 0.86 L3MBTL1 (0.60) ALDH1A1L3MBTL1MAPTLMNATSHR
SCHEMBL16490236 0.84 L3MBTL1 (0.58) ALDH1A1L3MBTL1MAPTLMNATSHR
SCHEMBL17083015 0.84 MAPT (0.51) ALDH1A1L3MBTL1MAPTLMNACYP1A2
SCHEMBL5255523 0.82 ALDH1A1 (0.65) ALDH1A1L3MBTL1MAPTLMNAPOLB
SCHEMBL27545152 0.80 ALDH1A1 (0.59) ALDH1A1L3MBTL1MAPTLMNAPOLB
SCHEMBL13373424 0.80 MAPT (0.48) ALDH1A1L3MBTL1MAPTLMNACYP1A2
SCHEMBL4585378 0.79 ALDH1A1 (0.57) ALDH1A1L3MBTL1MAPTLMNAPOLB
SCHEMBL13373488 0.79 L3MBTL1 (0.47) ALDH1A1L3MBTL1MAPTLMNACYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2023-09-21 US disclosed
US-11717514-B2 PSMA binding ligand-linker conjugates and methods for using PURDUE RESEARCH FOUNDATION (US) 2023-08-08 US disclosed
US-10010618-B2 Methods for treating cancer using combination therapies ENDOCYTE, INC. (US) 2018-07-03 US disclosed
US-9951324-B2 PSMA binding ligand-linker conjugates and methods for using PURDUE RESEARCH FOUNDATION (US) 2018-04-24 US disclosed
US-20170320826-A1 BIVALENT LINKERS AND CONJUGATES THEREOF ENDOCYTE INC (US) 2017-11-09 US disclosed
US-20170266303-A1 METHODS OF TREATING CANCER BY TARGETING TUMOR-ASSOCIATED MACROPHAGES PURDUE RESEARCH FOUNDATION 2017-09-21 US disclosed
US-20170258923-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2017-09-14 US disclosed
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2017-09-14 US disclosed
US-20170246314-A1 Folate Receptor Binding Conjugates of Antifolates PURDUE RESEARCH FOUNDATION (US) 2017-08-31 US disclosed
US-9662402-B2 Drug delivery conjugates containing unnatural amino acids and methods for using ENDOCYTE, INC. (US) 2017-05-30 US disclosed
US-20130158271-A1 BIVALENT LINKERS AND CONJUGATES THEREOF VLAHOV IONTCHO RADOSLAVOV (US) 2013-06-20 US disclosed
US-20130116195-A1 Binding ligand linked drug delivery conjugates of tubulysins LEAMON CHRISTOPHER PAUL (US) 2013-05-09 US disclosed
US-20120322741-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2012-12-20 US disclosed
US-8288557-B2 Bivalent linkers and conjugates thereof ENDOCYTE, INC. (US) 2012-10-16 US disclosed
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES PURDUE RESEARCH FOUNDATION (US) 2012-01-26 US disclosed
US-20110288152-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2011-11-24 US disclosed
US-20110172254-A1 FOLATE RECEPTOR BINDING CONJUGATES OF ANTIFOLATES ENDOCYTE, INC. (US) 2011-07-14 US disclosed
US-20100323973-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS ENDOCTYE, INC. 2010-12-23 US disclosed
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2010-12-23 US disclosed
US-20090203889-A1 Bivalent linkers and conjugates thereof ENDOCYTE, INC. (US) 2009-08-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (17 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885L3MBTL1 3227/4885MAPT 575/4885
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES FOLR1, FOLR2, DHFR ALDH1A1 1932/4885L3MBTL1 2304/4885MAPT 4250/4885
US-20090203889-A1 Bivalent linkers and conjugates thereof CCNB2, PAICS, FOLR2 ALDH1A1 1872/4885L3MBTL1 3458/4885MAPT 1253/4885
US-20130116195-A1 Binding ligand linked drug delivery conjugates of tubulysins TEK, TEKT1, CD2BP2 ALDH1A1 4745/4885L3MBTL1 2279/4885MAPT 1601/4885
US-10010618-B2 Methods for treating cancer using combination therapies SLC7A11, CXCR2, TPX2 ALDH1A1 831/4885L3MBTL1 1651/4885MAPT 3755/4885
US-20110288152-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2290/4885L3MBTL1 2707/4885MAPT 1738/4885
US-20170266303-A1 METHODS OF TREATING CANCER BY TARGETING TUMOR-ASSOCIATED MACROPHAGES FOLR1, FOLR2, FOLH1 ALDH1A1 1100/4885L3MBTL1 2174/4885MAPT 3663/4885
US-20120322741-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2748/4885L3MBTL1 3089/4885MAPT 600/4885
US-20170258923-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885L3MBTL1 3227/4885MAPT 575/4885
US-20170246314-A1 Folate Receptor Binding Conjugates of Antifolates FOLR1, FOLR2, DHFR ALDH1A1 1337/4885L3MBTL1 887/4885MAPT 2797/4885
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 ALDH1A1 642/4885L3MBTL1 986/4885MAPT 143/4885
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885L3MBTL1 3227/4885MAPT 575/4885
US-11717514-B2 PSMA binding ligand-linker conjugates and methods for using FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885L3MBTL1 3227/4885MAPT 575/4885
US-20100323973-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS CD44, HAVCR2, HCAR1 ALDH1A1 2723/4885L3MBTL1 1870/4885MAPT 1165/4885
US-20130158271-A1 BIVALENT LINKERS AND CONJUGATES THEREOF PAICS, FOLR2, DCLRE1A ALDH1A1 2328/4885L3MBTL1 1869/4885MAPT 1682/4885
US-20170320826-A1 BIVALENT LINKERS AND CONJUGATES THEREOF PAICS, FOLR2, DCLRE1A ALDH1A1 2328/4885L3MBTL1 1869/4885MAPT 1682/4885
US-20110172254-A1 FOLATE RECEPTOR BINDING CONJUGATES OF ANTIFOLATES FOLR1, FOLR2, DHFR ALDH1A1 1044/4885L3MBTL1 1433/4885MAPT 2340/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.