SCHEMBL7516840

SCHEMBL7516840

Cc1nc(/C=C/c2nc3ccsc3c(=O)n2-c2cccnc2C)cs1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.41
GRM5 P41594 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7516846 1.00 MEN1 (0.44) MEN1KMT2APOLBGRM5MAPT
SCHEMBL7508820 0.91 MEN1 (0.43) MEN1KMT2APOLBGRM5MAPT
SCHEMBL7508826 0.91 MEN1 (0.43) MEN1KMT2APOLBGRM5MAPT
SCHEMBL7521414 0.82 TP53 (0.55) MEN1KMT2APOLBMAPT
SCHEMBL7711199 0.82 KMT2A (0.44) MEN1KMT2APOLBGRM5
SCHEMBL6614084 0.81
SCHEMBL6614081 0.81
SCHEMBL6222400 0.79 MEN1 (0.69) MEN1KMT2APOLBMAPTSMN1; SMN2
SCHEMBL7515631 0.79 PDE7A (0.43) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL6614814 0.77

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807633-B1 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER (US) 2002-11-06 EP claimed
EP-0807633-A2 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER INC. (US) 1997-11-19 EP claimed
EP-0807633-B1 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER (US) 2002-11-06 EP disclosed
EP-0807633-A2 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER INC. (US) 1997-11-19 EP disclosed