SCHEMBL9237998

SCHEMBL9237998

Cc1nc(C)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c(=O)c1Cc1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
NPC1 O15118 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL9234703 0.92 PPARG (0.41) PPARG
SCHEMBL9230386 0.91 PPARG (0.43) PPARGNPC1KMT2ASMN1; SMN2
SCHEMBL9237228 0.91 AGTR1 (0.44)
SCHEMBL9230511 0.89 AGTR1 (0.52) PPARG
SCHEMBL8979902 0.88
SCHEMBL9236476 0.87 PPARG (0.56) PPARG
SCHEMBL9233027 0.86 PPARG (0.45) PPARGNPC1KMT2ASMN1; SMN2
SCHEMBL9234718 0.84 AGTR1 (0.47)
SCHEMBL9234122 0.83 AGTR1 (0.43)
SCHEMBL9237251 0.83 PPARG (0.45) 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-0685467-A1 NOVEL PYRIMIDINE DERIVATIVE AND MEDICINAL COMPOSITION NKK CORPORATION (JP) 1995-12-06 EP disclosed