SCHEMBL5806328

SCHEMBL5806328

COc1ccc(C(=O)c2nc[nH]c2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
PDE10A Q9Y233 1/20 0.47
KMT2A Q03164 4/20 0.47
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
MAPK1 P28482 2/20 0.46
HPGD P15428 2/20 0.46
RXFP1 Q9HBX9 2/20 0.46
MEN1 O00255 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NPC1 O15118 3/20 0.46
BRD4 O60885 1/20 0.46
PARP1 P09874 1/20 0.46
PARP10 Q53GL7 1/20 0.46
PARP2 Q9UGN5 1/20 0.46
PARP4 Q9UKK3 1/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 2/20 0.46

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
SCHEMBL5805872 0.83 NPC1 (0.49) RAB9AMAPTLMNAMAPK1HPGD
SCHEMBL5804085 0.79 HSD17B10 (0.59) KMT2ARAB9AMAPTMAPK1HPGD
SCHEMBL7640806 0.77 KMT2A (0.44) CA1CA2KMT2ARAB9AMAPT
SCHEMBL3258892 0.76 GDA (0.43) KMT2AMAPTLMNAMAPK1MEN1
SCHEMBL5433655 0.73 NPSR1 (0.46) KMT2AMAPTLMNAHPGDMEN1
SCHEMBL3207077 0.73 PDE10A (0.47) CA1CA2PDE10AKMT2ARAB9A
SCHEMBL9418310 0.72 RXFP1 (0.79) CA1CA2KMT2ARAB9AMAPT
SCHEMBL51509 0.72 RXFP1 (0.79) CA1CA2KMT2ARAB9AMAPT
SCHEMBL6255790 0.72 RAB9A (0.51) CA1CA2PDE10AKMT2ARAB9A
SCHEMBL5141691 0.71 MAPK1 (0.67) CA1CA2KMT2ARAB9AMAPT

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-2006084835-A1 N-(3-(IMIDAZO [1,5-A]PYRIMIDIN-4-YL)PHENYL]-SULFONAMIDES AND N-[3-(IMIDAZO[1,5-A]PYRIMIDIN-4-YL)-PHENYL]-CARBOXAMIDES AND THEIR USE AS GABAA RECEPTOR MODULATORS FERRER INTERNACIONAL, S. A. (ES) 2006-08-17 WO claimed
WO-2006084835-A1 N-(3-(IMIDAZO [1,5-A]PYRIMIDIN-4-YL)PHENYL]-SULFONAMIDES AND N-[3-(IMIDAZO[1,5-A]PYRIMIDIN-4-YL)-PHENYL]-CARBOXAMIDES AND THEIR USE AS GABAA RECEPTOR MODULATORS FERRER INTERNACIONAL, S. A. (ES) 2006-08-17 WO disclosed