SCHEMBL7307292

SCHEMBL7307292

CCc1nc2ccc(-c3cc4ccccc4cn3)cc2n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.51
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
SCHEMBL7309147 0.93 PPARG (0.60) PPARG
SCHEMBL7307288 0.88 PPARG (0.65) PPARGAGTR1AGTR2
SCHEMBL9042383 0.84 PPARG (0.60) PPARGAGTR1AGTR2
SCHEMBL8789680 0.83 PPARG (0.48) PPARGAGTR1AGTR2
SCHEMBL8788890 0.82 PPARG (0.55) PPARGAGTR1AGTR2
SCHEMBL7311606 0.81 AGTR1 (0.56) PPARGAGTR1AGTR2
SCHEMBL7309146 0.81 PPARG (0.77) PPARG
SCHEMBL7307392 0.81 PPARG (0.59) PPARGAGTR1AGTR2
SCHEMBL8788943 0.80 PPARG (0.46) PPARG
SCHEMBL9042831 0.79 PPARG (0.74) PPARG

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-0502314-A1 Benzimidazol, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-09 EP disclosed