SCHEMBL435406

SCHEMBL435406

CN(C)CC(=O)NCCC=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL20801640 0.85 MEN1 (0.40) DNM1MEN1KMT2AALDH1A1HTT
SCHEMBL19371885 0.80 ALDH1A1 (0.38) MEN1KMT2AALDH1A1TSHRKDM4E
SCHEMBL13997591 0.78 PRMT3 (0.39) DNM1MEN1KMT2AALDH1A1USP2
SCHEMBL22382538 0.78 DNM1 (0.36) DNM1MEN1KMT2AALDH1A1USP2
SCHEMBL17450515 0.78 MAPT (0.36) MEN1KMT2AALDH1A1HTTTSHR
SCHEMBL8227224 0.78 KDM4E (0.46) DNM1MEN1KMT2AALDH1A1USP2
SCHEMBL8741153 0.78 MEN1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1827225 0.78 MEN1 (0.54) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL10111497 0.76 CA1 (0.43) TSHRKDM4E
SCHEMBL2127728 0.76 MCL1 (0.48) DNM1MEN1KMT2ATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782493-B2 Conjugates for treating diseases caused by PSMA expressing cells ENDOCYTE, INC. (US) 2017-10-10 US disclosed
US-20170266303-A1 METHODS OF TREATING CANCER BY TARGETING TUMOR-ASSOCIATED MACROPHAGES PURDUE RESEARCH FOUNDATION 2017-09-21 US disclosed
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2017-09-14 US disclosed
US-20170151340-A1 Conjugates Containing Hydrophilic Spacer Linkers ENDOCYTE INC (US) 2017-06-01 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-9636413-B2 Conjugates for treating diseases caused by PSMA expressing cells ENDOCYTE, INC. (US) 2017-05-02 US disclosed
US-20160361376-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE, INC. 2016-12-15 US disclosed
US-20160361433-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2016-12-15 US disclosed
US-20160361432-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (IN) 2016-12-15 US disclosed
US-20160287731-A1 Compounds for Positron Emission Tomography ENDOCYTE, INC 2016-10-06 US disclosed
US-20140073761-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS ENDOCYTE, INC. (US) 2014-03-13 US disclosed
US-20140066594-A1 BINDING LIGAND LINKED DRUG DELIVERY CONJUGATES OF TUBULYSINS ENDOCYTE, INC. (US) 2014-03-06 US disclosed
US-20140058063-A1 VITAMIN RECEPTOR BINDING DRUG DELIVERY CONJUGATES ENDOCYTE, INC. (US) 2014-02-27 US disclosed
US-20140058064-A1 MULTI-DRUG LIGAND CONJUGATES ENDOCYTE, INC. (US) 2014-02-27 US disclosed
US-20130184435-A1 MULTI-DRUG LIGAND CONJUGATES ENDOCYTE, INC. (US) 2013-07-18 US disclosed
US-20130116195-A1 Binding ligand linked drug delivery conjugates of tubulysins LEAMON CHRISTOPHER PAUL (US) 2013-05-09 US disclosed
US-20120270791-A1 Methods and Compositions for Treating and Diagnosing Kidney Disease LEAMON CHRISTOPHER PAUL (US) 2012-10-25 US disclosed
US-20120065149-A1 Vitamin receptor binding drug delivery conjugates VLAHOV IONTCHO R (US) 2012-03-15 US disclosed
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES PURDUE RESEARCH FOUNDATION (US) 2012-01-26 US disclosed
US-20100323973-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS ENDOCTYE, INC. 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-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES FOLR1, FOLR2, DHFR DNM1 1906/4885MEN1 3080/4885KMT2A 1861/4885
US-20130116195-A1 Binding ligand linked drug delivery conjugates of tubulysins TEK, TEKT1, CD2BP2 DNM1 1023/4885MEN1 1052/4885KMT2A 3145/4885
US-20160361376-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 DNM1 792/4885MEN1 186/4885KMT2A 961/4885
US-20140066594-A1 BINDING LIGAND LINKED DRUG DELIVERY CONJUGATES OF TUBULYSINS TEK, TEKT1, VDR DNM1 1217/4885MEN1 1861/4885KMT2A 3742/4885
US-20170266303-A1 METHODS OF TREATING CANCER BY TARGETING TUMOR-ASSOCIATED MACROPHAGES FOLR1, FOLR2, FOLH1 DNM1 1712/4885MEN1 1102/4885KMT2A 1101/4885
US-20130184435-A1 MULTI-DRUG LIGAND CONJUGATES VDR, CD44, HCAR1 DNM1 1763/4885MEN1 2464/4885KMT2A 3709/4885
US-20160361432-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 DNM1 792/4885MEN1 186/4885KMT2A 961/4885
US-20120065149-A1 Vitamin receptor binding drug delivery conjugates VDR, CYP2R1, CYP24A1 DNM1 2356/4885MEN1 3425/4885KMT2A 2852/4885
US-20170151340-A1 Conjugates Containing Hydrophilic Spacer Linkers CD44, HAVCR2, HCAR1 DNM1 356/4885MEN1 2245/4885KMT2A 3989/4885
US-20120270791-A1 Methods and Compositions for Treating and Diagnosing Kidney Disease VDR, GC, CYP24A1 DNM1 1355/4885MEN1 1833/4885KMT2A 4582/4885
US-20140058064-A1 MULTI-DRUG LIGAND CONJUGATES VDR, CD44, HCAR1 DNM1 1763/4885MEN1 2464/4885KMT2A 3709/4885
US-20160361433-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 DNM1 792/4885MEN1 186/4885KMT2A 961/4885
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 DNM1 792/4885MEN1 186/4885KMT2A 961/4885
US-20140058063-A1 VITAMIN RECEPTOR BINDING DRUG DELIVERY CONJUGATES VDR, CYP2R1, CYP24A1 DNM1 2356/4885MEN1 3425/4885KMT2A 2852/4885
US-20160287731-A1 Compounds for Positron Emission Tomography FOLH1, FOLR2, FOLR1 DNM1 2281/4885MEN1 259/4885KMT2A 1947/4885
US-20100323973-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS CD44, HAVCR2, HCAR1 DNM1 356/4885MEN1 2245/4885KMT2A 3989/4885
US-20140073761-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS CD44, HAVCR2, HCAR1 DNM1 356/4885MEN1 2245/4885KMT2A 3989/4885

“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.