SCHEMBL9200311

SCHEMBL9200311

CCCc1nc(-n2cccc2)c(CO)[nH]1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.37
ADORA2A P29274 2/20 0.37
ADORA1 P30542 2/20 0.37
KMT2A Q03164 1/20 0.31
POLB P06746 1/20 0.31
AGTR1 P30556 1/20 0.30
AGTR2 P50052 1/20 0.30
KDM4C Q9H3R0 1/20 0.30

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
SCHEMBL9201648 0.91 ALDH1A1 (0.39) AGTR1AGTR2
SCHEMBL9202020 0.78 ALDH1A1 (0.44) ADORA3ADORA2AADORA1KMT2APOLB
SCHEMBL9198235 0.77 ADORA3 (0.36) ADORA3ADORA2AADORA1KMT2APOLB
SCHEMBL9141210 0.75 ADORA3 (0.34) ADORA3ADORA2AADORA1KMT2APOLB
SCHEMBL9200290 0.74 POLB (0.36) ADORA3ADORA2AADORA1KMT2APOLB
SCHEMBL30296175 0.73 GLA (0.34) ADORA3ADORA2AADORA1POLBKDM4C
SCHEMBL9200090 0.73 ALDH1A1 (0.34) KMT2AAGTR1AGTR2
SCHEMBL9137917 0.72 HPGD (0.43) AGTR1AGTR2
SCHEMBL4356818 0.71 GLA (0.35) ADORA3ADORA2AADORA1KMT2APOLB
SCHEMBL9205499 0.70 PARP1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0643709-A1 4-(1-$i(H)-PYRROL-1-YL)IMIDAZOLES WITH ANGIOTENSIN II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1995-03-22 EP claimed
US-5210211-A 4-(1H-PYRROL-1-YL) IMIDAZOLES WITH ANGIOTENSION II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1993-05-11 US claimed
WO-1993000341-A1 4-(1-H-PYRROL-1-YL)IMIDAZOLES WITH ANGIOTENSIN II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1993-01-07 WO claimed
EP-0643709-A1 4-(1-$i(H)-PYRROL-1-YL)IMIDAZOLES WITH ANGIOTENSIN II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1995-03-22 EP disclosed
US-5276048-A 4-(1H-pyrrol-1-yl)imidazoles with angiotensin II antagonist activity WARNER-LAMBERT COMPANY (US) 1994-01-04 US disclosed
US-5210211-A 4-(1H-PYRROL-1-YL) IMIDAZOLES WITH ANGIOTENSION II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1993-05-11 US disclosed
WO-1993000341-A1 4-(1-H-PYRROL-1-YL)IMIDAZOLES WITH ANGIOTENSIN II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1993-01-07 WO disclosed