SCHEMBL9705030

SCHEMBL9705030

CCCCc1nc2ccc(N3CCCCC3=O)nc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.47
AGTR2 P50052 5/20 0.47

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
SCHEMBL9704390 0.98 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9705205 0.95 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9705226 0.94 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9704791 0.88 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8788936 0.86 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8789134 0.85 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9704961 0.84 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9704933 0.84 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8788274 0.84 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9705140 0.84 AGTR1 (0.49) 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-0470543-A1 Heterocyclic imidazoles, remedies containing them and processes for their preparation Dr. Karl Thomae GmbH (DE) 1992-02-12 EP disclosed