SCHEMBL9704791

SCHEMBL9704791

CCCCc1nc2ccc(N3CCCN(Cc4ccccc4)C3=O)nc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.45
AGTR2 P50052 1/20 0.45

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
SCHEMBL9704651 0.96 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9705030 0.88 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9704390 0.88 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9096036 0.87 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9095782 0.86 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9705205 0.84 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9705226 0.84 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9705248 0.84 AGT (0.55) AGTR1AGTR2
SCHEMBL9704422 0.83 AGTR2 (0.44) AGTR1AGTR2
SCHEMBL9096342 0.82 PPARG (0.45)

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