SCHEMBL9704761

SCHEMBL9704761

CCCc1nc2ccc(N)nc2n1Cc1ccc(-c2ccccc2OC(=O)OC(C)(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.49
AGTR1 P30556 3/20 0.48
AGTR2 P50052 3/20 0.48

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
SCHEMBL9705897 0.95 AGTR1 (0.49) PPARGAGTR1AGTR2
SCHEMBL9705172 0.86 AGTR1 (0.52) PPARGAGTR1AGTR2
SCHEMBL9043476 0.86 PPARG (0.65) PPARGAGTR1AGTR2
SCHEMBL9704411 0.86 AGTR1 (0.44) PPARGAGTR1AGTR2
SCHEMBL9704078 0.85 AGTR1 (0.48) PPARGAGTR1AGTR2
SCHEMBL9705117 0.85 AGTR1 (0.49) PPARGAGTR1AGTR2
SCHEMBL9705279 0.84 AGTR1 (0.46) PPARGAGTR1AGTR2
SCHEMBL9704128 0.84 KDM4E (0.55) PPARGAGTR1AGTR2
SCHEMBL9704334 0.84 AGTR1 (0.48) PPARGAGTR1AGTR2
SCHEMBL9704335 0.84 AGTR1 (0.50) PPARGAGTR1AGTR2

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