SCHEMBL9843837

SCHEMBL9843837

CCCCc1c(C)nc(CCCC)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c1=O

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.59
PPARG P37231 5/20 0.59

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
SCHEMBL9844027 0.98 AGTR1 (0.58) AGTR1PPARG
SCHEMBL9843911 0.96 AGTR1 (0.58) AGTR1PPARG
SCHEMBL9844327 0.94 PPARG (0.61) AGTR1PPARG
SCHEMBL9231293 0.94 PPARG (0.63) AGTR1PPARG
SCHEMBL7818608 0.93 PPARG (0.57) AGTR1PPARG
SCHEMBL7821638 0.93 PPARG (0.57) AGTR1PPARG
SCHEMBL9844155 0.93 AGTR1 (0.53) AGTR1PPARG
SCHEMBL7819440 0.92 PPARG (0.61) AGTR1PPARG
SCHEMBL6959880 0.92 AGTR1 (0.58) AGTR1PPARG
SCHEMBL6971961 0.92 PPARG (0.61) AGTR1PPARG

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-0407342-A2 Pyrimidine derivatives CIBA-GEIGY AG (CH) 1991-01-09 EP disclosed