SCHEMBL9044992

SCHEMBL9044992

CCCCc1nc(C)c(-c2ccccc2C(F)(F)F)c(=O)n1Cc1ccc(OCc2ccccc2C(=O)O)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.44

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
SCHEMBL9042604 0.93 FFAR1 (0.47) PPARG
SCHEMBL9040877 0.92 PPARG (0.45) PPARG
SCHEMBL9041516 0.91 AGTR1 (0.46)
SCHEMBL9044997 0.90 AGTR1 (0.45)
SCHEMBL9042682 0.89 PPARG (0.46) PPARG
SCHEMBL9044003 0.88 MRGPRX4 (0.46)
SCHEMBL9044886 0.88 MRGPRX4 (0.46)
SCHEMBL9042339 0.86 MRGPRX4 (0.43)
SCHEMBL9042685 0.86 AGTR1 (0.40) PPARG
SCHEMBL9043505 0.86 AGTR1 (0.47)

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-0515535-A4 ANGIOTENSIN II ANTAGONISTS INCORPORATING A SUBSTITUTED BENZYL ELEMENT MERCK & CO INC (US) 1996-01-17 EP disclosed