SCHEMBL10172752

SCHEMBL10172752

CSC(C)(C)COC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
LMNA P02545 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TSHR P16473 1/20 0.38
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
GAA P10253 2/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 1/20 0.33
TBXA2R P21731 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRNA10 Q9GZZ6 1/20 0.33

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
SCHEMBL15044666 0.85 ACHE (0.33) ALDH1A1LMNAHSD17B10ACHE
SCHEMBL19564952 0.82 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL19564951 0.79 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL22479770 0.77 ALDH1A1 (0.36) ALDH1A1LMNAHSD17B10TSHRRAB9A
SCHEMBL15044669 0.74 ALDH1A1 (0.34) ALDH1A1LMNAHSD17B10
SCHEMBL12971915 0.74 ALDH1A1 (0.34) ALDH1A1LMNAHSD17B10
SCHEMBL14627793 0.74 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL3199088 0.74 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRCHRM5
SCHEMBL697625 0.74
SCHEMBL10171465 0.73 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRCHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2023-11-02 US disclosed
US-20230330249-A1 ANTIBODY-CONJUGATED CHEMICAL INDUCERS OF DEGRADATION OF BRM AND METHODS THEREOF GENENTECH, INC. (US) 2023-10-19 US disclosed
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-20180221372-A1 VITAMIN RECEPTOR DRUG DELIVERY CONJUGATES FOR TREATING INFLAMMATION ENDOCYTE INC (US) 2018-08-09 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-20170290920-A1 ANTI-CD22 ANTIBODIES AND IMMUNOCONJUGATES MEDIMMUNE LIMITED (GB) 2017-10-12 US disclosed
US-9782493-B2 Conjugates for treating diseases caused by PSMA expressing cells ENDOCYTE, INC. (US) 2017-10-10 US disclosed
US-8546425-B2 Folate receptor binding conjugates of antifolates PURDUE RESEARCH FOUNDATION (US) 2013-10-01 US disclosed
US-20130203680-A1 FOLATE CONJUGATES FOR TREATING INFLAMMATION OF THE EYE ENDOCYTE, INC. (US) 2013-08-08 US disclosed
US-20130184435-A1 MULTI-DRUG LIGAND CONJUGATES ENDOCYTE, INC. (US) 2013-07-18 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-20120258905-A1 VITAMIN RECEPTOR DRUG DELIVERY CONJUGATES FOR TREATING INFLAMMATION ENDOCYTE, INC. (US) 2012-10-11 US disclosed
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES PURDUE RESEARCH FOUNDATION (US) 2012-01-26 US disclosed
US-20110172254-A1 FOLATE RECEPTOR BINDING CONJUGATES OF ANTIFOLATES ENDOCYTE, INC. (US) 2011-07-14 US disclosed
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2010-12-23 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 2843/4885LMNA 2066/4885HSD17B10 2817/4885
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES FOLR1, FOLR2, DHFR ALDH1A1 1932/4885LMNA 2529/4885HSD17B10 4195/4885
US-20130116195-A1 Binding ligand linked drug delivery conjugates of tubulysins TEK, TEKT1, CD2BP2 ALDH1A1 4745/4885LMNA 2494/4885HSD17B10 3551/4885
US-20120258905-A1 VITAMIN RECEPTOR DRUG DELIVERY CONJUGATES FOR TREATING INFLAMMATION VDR, HCAR1, CYP2R1 ALDH1A1 885/4885LMNA 1114/4885HSD17B10 413/4885
US-10010618-B2 Methods for treating cancer using combination therapies SLC7A11, CXCR2, TPX2 ALDH1A1 831/4885LMNA 4453/4885HSD17B10 1231/4885
US-20130184435-A1 MULTI-DRUG LIGAND CONJUGATES VDR, CD44, HCAR1 ALDH1A1 516/4885LMNA 1724/4885HSD17B10 1662/4885
US-20170290920-A1 ANTI-CD22 ANTIBODIES AND IMMUNOCONJUGATES CD22, CD2, CD2BP2 ALDH1A1 260/4885LMNA 4493/4885HSD17B10 2456/4885
US-20120322741-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2748/4885LMNA 2077/4885HSD17B10 2833/4885
US-20180221372-A1 VITAMIN RECEPTOR DRUG DELIVERY CONJUGATES FOR TREATING INFLAMMATION VDR, HCAR1, CYP2R1 ALDH1A1 885/4885LMNA 1114/4885HSD17B10 413/4885
US-20230330249-A1 ANTIBODY-CONJUGATED CHEMICAL INDUCERS OF DEGRADATION OF BRM AND METHODS THEREOF ADRM1, CD79B, BRDT ALDH1A1 1936/4885LMNA 2374/4885HSD17B10 2716/4885
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885LMNA 2066/4885HSD17B10 2817/4885
US-11717514-B2 PSMA binding ligand-linker conjugates and methods for using FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885LMNA 2066/4885HSD17B10 2817/4885
US-20130158271-A1 BIVALENT LINKERS AND CONJUGATES THEREOF PAICS, FOLR2, DCLRE1A ALDH1A1 2328/4885LMNA 1496/4885HSD17B10 2411/4885
US-20130203680-A1 FOLATE CONJUGATES FOR TREATING INFLAMMATION OF THE EYE FOLR2, FOLR1, DHFR ALDH1A1 336/4885LMNA 4069/4885HSD17B10 1582/4885
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 ALDH1A1 2843/4885LMNA 2066/4885HSD17B10 2817/4885
US-20170320826-A1 BIVALENT LINKERS AND CONJUGATES THEREOF PAICS, FOLR2, DCLRE1A ALDH1A1 2328/4885LMNA 1496/4885HSD17B10 2411/4885
US-20110172254-A1 FOLATE RECEPTOR BINDING CONJUGATES OF ANTIFOLATES FOLR1, FOLR2, DHFR ALDH1A1 1044/4885LMNA 3893/4885HSD17B10 991/4885

“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.