SCHEMBL8210583

SCHEMBL8210583

Cc1nc(-c2cc[c]c(F)c2)co1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 5/20 0.49
ENPP1 P22413 3/20 0.49
SCN9A Q15858 1/20 0.42
KMT2A Q03164 2/20 0.40
POLB P06746 4/20 0.38
TP53 P04637 3/20 0.38
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
PKM P14618 1/20 0.34
NPC1 O15118 1/20 0.34
NR2F2 P24468 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL27618779 0.81 ENPP3 (0.49) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL2438565 0.75 ENPP3 (0.63) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL8228630 0.75 ENPP3 (0.58) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL8418313 0.73 ENPP3 (0.56) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL8257975 0.73 ENPP3 (0.56) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL10263247 0.73 ENPP3 (0.59) ENPP3ENPP1SCN9AKMT2AMAPT
SCHEMBL6986241 0.72 ENPP3 (0.69) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL12021820 0.71 ENPP3 (0.53) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL13450985 0.71 ENPP3 (0.53) ENPP3ENPP1SCN9AKMT2APOLB
SCHEMBL8221400 0.71 ENPP3 (0.53) ENPP3ENPP1SCN9AKMT2APOLB

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-0968194-A1 ATROPISOMERS OF 3-ARYL-4(3H)-QUINAZOLINONES AND THEIR USE AS AMPA-RECEPTOR ANTAGONISTS Pfizer Products Inc. (US) 2000-01-05 EP disclosed
EP-0901487-A1 NOVEL 2,3 DISUBSTITUTED-4(3H)-QUINAZOLINONES PFIZER INC. (US) 1999-03-17 EP disclosed
WO-1998038173-A1 ATROPISOMERS OF 3-ARYL-4(3H)-QUINAZOLINONES AND THEIR USE AS AMPA-RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 1998-09-03 WO disclosed
WO-1997043276-A1 NOVEL 2,3 DISUBSTITUTED-4(3H)-QUINAZOLINONES PFIZER INC. (US) 1997-11-20 WO disclosed