SCHEMBL4753206

SCHEMBL4753206

CSc1ccc(-n2c(N)nc3ccc(C(=O)O)cc3c2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HPD P32754 8/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.40
MMP13 P45452 1/20 0.40

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
SCHEMBL4756572 0.80 TTR (0.43) MAPK1HPDNPSR1L3MBTL1
SCHEMBL4755109 0.77 SMN1; SMN2 (0.44) MEN1KMT2AMAPT
SCHEMBL4756570 0.76 ALDH1A1 (0.50) MAPK1MEN1KMT2AMAPT
SCHEMBL4756548 0.74 GAA (0.46) MEN1KMT2AHPDMAPT
SCHEMBL9954526 0.72 POLB (0.54) MAPTATM
SCHEMBL4756539 0.71 PTGFR (0.41) MAPK1MEN1KMT2AHPD
SCHEMBL11270745 0.68 ALPG (0.67) MEN1KMT2A
SCHEMBL9953980 0.66 ATM (0.51) MEN1KMT2AL3MBTL1MAPTATM
SCHEMBL9953324 0.66 HCAR1 (0.50) MAPK1
SCHEMBL18950565 0.66 HSD17B10 (0.70) L3MBTL1

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
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO claimed
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO disclosed