SCHEMBL7517191

SCHEMBL7517191

N#Cc1ccccc1/C=C/c1nc2ccsc2c(=O)n1-c1ccccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.51
LMNA P02545 1/20 0.51
PDE7A Q13946 2/20 0.43
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
PDE4B Q07343 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
SCHEMBL7511743 1.00 TP53 (0.51) TP53LMNAPDE7AKMT2AMEN1
SCHEMBL7558097 0.89 PDE7A (0.41) TP53LMNAPDE7AKMT2AMEN1
SCHEMBL7507708 0.88 TP53 (0.53) TP53PDE7AKMT2AMEN1POLB
SCHEMBL7507712 0.88 TP53 (0.53) TP53PDE7AKMT2AMEN1POLB
SCHEMBL6222276 0.85 LMNA (0.54) TP53LMNAKMT2A
SCHEMBL6222277 0.85 LMNA (0.54) TP53LMNAKMT2A
SCHEMBL7509348 0.85 PDE7A (0.41) TP53LMNAPDE7AKMT2AMEN1
SCHEMBL7509354 0.85 PDE7A (0.41) TP53LMNAPDE7AKMT2AMEN1
SCHEMBL7515631 0.85 PDE7A (0.43) TP53LMNAPDE7AKMT2AMEN1
SCHEMBL7512391 0.85 KMT2A (0.57) TP53LMNAKMT2AMEN1POLB

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