SCHEMBL9707397

SCHEMBL9707397

CCCCc1nc2c(c(=O)n(CCOC)c(=O)n2CCC)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 10/20 0.47
AGTR2 P50052 10/20 0.47
PPARG P37231 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
SCHEMBL9708055 1.00 AGTR1 (0.47) AGTR1AGTR2PPARG
SCHEMBL9708638 0.98 AGTR1 (0.45) AGTR1AGTR2PPARG
SCHEMBL9708320 0.98 AGTR1 (0.45) AGTR1AGTR2PPARG
SCHEMBL9707987 0.96 AGTR1 (0.47) AGTR1AGTR2PPARG
SCHEMBL9707912 0.95 AGTR1 (0.47) AGTR1AGTR2PPARG
SCHEMBL9707903 0.95 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9708618 0.95 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9707652 0.95 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9707875 0.95 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9708828 0.94 AGTR1 (0.51) 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
WO-1992007845-A1 DERIVATIVES OF AMINO ACIDS AS INHIBITORS OF RENIN, METHODS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1992-05-14 WO disclosed