SCHEMBL9704755

SCHEMBL9704755

CCCCc1nc2ccnc(Cl)c2n1Cc1ccc(-c2ccccc2OC(=O)OC(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 5/20 0.49
AGTR1 P30556 4/20 0.49
PPARG P37231 1/20 0.46

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
SCHEMBL9704687 0.89 AGTR2 (0.53) AGTR2AGTR1
SCHEMBL9704652 0.87 AGTR1 (0.49) AGTR2AGTR1PPARG
SCHEMBL9040271 0.87 AGTR2 (0.52) AGTR2AGTR1
SCHEMBL9039227 0.87 AGTR2 (0.52) AGTR2AGTR1
SCHEMBL9043130 0.86 AGTR1 (0.51) AGTR2AGTR1PPARG
SCHEMBL9040250 0.86 AGTR2 (0.51) AGTR2AGTR1PPARG
SCHEMBL9041236 0.86 AGTR1 (0.66) AGTR2AGTR1PPARG
SCHEMBL9041454 0.85 PPARG (0.52) AGTR2AGTR1PPARG
SCHEMBL9042748 0.84 AGTR1 (0.58) AGTR2AGTR1PPARG
SCHEMBL9044658 0.83 AGTR2 (0.48) AGTR2AGTR1PPARG

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