SCHEMBL9846728

SCHEMBL9846728

CCCCc1nccn1Cc1ccc2[nH]c(-c3ccccc3C(=O)O)cc2c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.67
AGTR2 P50052 4/20 0.67
PPARG P37231 1/20 0.45
FFAR1 O14842 1/20 0.45
BRS3 P32247 1/20 0.44

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
SCHEMBL9846708 0.91 AGTR1 (0.54) AGTR1AGTR2PPARGFFAR1
SCHEMBL9846795 0.85 AGTR1 (0.48) AGTR1AGTR2PPARGFFAR1
SCHEMBL9846714 0.83 AGTR1 (0.47) AGTR1AGTR2PPARGFFAR1
SCHEMBL9846721 0.82 AGTR1 (0.64) AGTR1AGTR2BRS3
SCHEMBL9846768 0.81 AGTR1 (0.69) AGTR1AGTR2PPARG
SCHEMBL27317908 0.81 AGTR1 (1.00) AGTR1AGTR2
SCHEMBL9846764 0.80 AGTR1 (0.62) AGTR1AGTR2BRS3
SCHEMBL9309923 0.80 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL9309933 0.80 AGTR1 (0.66) AGTR1AGTR2
SCHEMBL9846705 0.79 AGTR1 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0429257-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1991-05-29 EP disclosed