SCHEMBL8799310

SCHEMBL8799310

CCCCc1nc(Cl)[c]n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.47
AGTR2 P50052 6/20 0.47
GP6 Q9HCN6 1/20 0.44
ABCC4 O15439 1/20 0.42
ABCB11 O95342 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42

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
SCHEMBL8800792 0.91 AGTR1 (0.41) AGTR1AGTR2GP6
SCHEMBL8105649 0.82 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL29382524 0.82 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL15944209 0.82 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL940 0.81 GP6 (0.56) AGTR1AGTR2GP6ABCC4ABCB11
SCHEMBL3347428 0.81 GP6 (0.54) AGTR1AGTR2GP6ABCC4ABCB11
SCHEMBL3347424 0.80 GP6 (0.53) AGTR1AGTR2GP6ABCC4ABCB11
SCHEMBL13755335 0.80 AGTR1 (0.58) AGTR1AGTR2GP6ABCC4ABCB11
SCHEMBL6953051 0.80 HSD11B1 (0.47) AGTR1AGTR2
SCHEMBL9031100 0.80 AGTR1 (0.72) AGTR1AGTR2

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-0763033-A1 IMIDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1997-03-19 EP claimed
WO-1995032198-A1 IMIDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-11-30 WO claimed
EP-0763033-A1 IMIDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1997-03-19 EP disclosed
WO-1995032198-A1 IMIDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-11-30 WO disclosed