SCHEMBL30437002

SCHEMBL30437002

N#Cc1ccc(F)c(C(=O)Nc2ccc(-c3cccnc3)nc2)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.62
GRM5 P41594 6/20 0.56
CYP11B2 P19099 3/20 0.50
CYP11B1 P15538 2/20 0.50
ATR Q13535 1/20 0.49
SGMS2 Q8NHU3 1/20 0.48
ABL1 P00519 1/20 0.48
PDGFRB P09619 1/20 0.48
BCR P11274 1/20 0.48
PDGFRA P16234 1/20 0.48
PRKCA P17252 1/20 0.48
BRAF P15056 2/20 0.48
LRRK2 Q5S007 1/20 0.45
MAPT P10636 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
SCHEMBL21055977 1.00 PPARG (0.62) PPARGGRM5CYP11B2CYP11B1ATR
SCHEMBL30436845 0.89 PPARG (0.77) PPARGGRM5LRRK2
SCHEMBL21056021 0.89 PPARG (0.77) PPARGGRM5LRRK2
SCHEMBL21055976 0.88 PPARG (0.81) PPARGCYP11B2CYP11B1ATRSGMS2
SCHEMBL30436387 0.88 PPARG (0.78) PPARGGRM5CYP11B2CYP11B1ATR
SCHEMBL21056003 0.88 PPARG (0.78) PPARGGRM5CYP11B2CYP11B1ATR
SCHEMBL30436599 0.88 PPARG (0.81) PPARGCYP11B2CYP11B1ATRSGMS2
SCHEMBL21056011 0.87 PPARG (0.64) PPARGGRM5
SCHEMBL30435682 0.87 PPARG (0.64) PPARGGRM5
SCHEMBL21056019 0.87 GRM5 (0.67) PPARGGRM5CYP11B2CYP11B1SGMS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111630030-B Novel benzamide derivatives as PPAR-gamma modulators 梅迪比奥法尔玛公司 2023-06-20 CN claimed
CN-111630030-B Novel benzamide derivatives as PPAR-gamma modulators 梅迪比奥法尔玛公司 2023-06-20 CN disclosed