SCHEMBL30436845

SCHEMBL30436845

N#Cc1ccc(F)c(C(=O)Nc2ccc(-c3ccncc3)nc2)c1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.77
GRM5 P41594 7/20 0.56
PTPN1 P18031 2/20 0.46
PTPN6 P29350 1/20 0.46
PTPN11 Q06124 1/20 0.46
KCNQ3 O43525 1/20 0.45
KCNQ2 O43526 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LRRK2 Q5S007 1/20 0.43
WNT3A P56704 1/20 0.43
GRM4 Q14833 1/20 0.42
CSNK1D P48730 1/20 0.42
CSNK1E P49674 1/20 0.42
PTPN2 P17706 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
SCHEMBL21056021 1.00 PPARG (0.77) PPARGGRM5PTPN1PTPN6PTPN11
SCHEMBL30435682 0.91 PPARG (0.64) PPARGGRM5PTPN1PTPN6PTPN11
SCHEMBL21056011 0.91 PPARG (0.64) PPARGGRM5PTPN1PTPN6PTPN11
SCHEMBL21055977 0.89 PPARG (0.62) PPARGGRM5LRRK2
SCHEMBL30437002 0.89 PPARG (0.62) PPARGGRM5LRRK2
SCHEMBL21055998 0.87 PPARG (1.00) PPARGGRM5LRRK2WNT3AGRM4
SCHEMBL30436494 0.87 PPARG (1.00) PPARGGRM5LRRK2WNT3AGRM4
SCHEMBL30436815 0.86 PPARG (0.67) PPARGGRM5MEN1KMT2ALRRK2
SCHEMBL21056004 0.86 PPARG (0.67) PPARGGRM5MEN1KMT2ALRRK2
SCHEMBL31171364 0.84 GRM5 (0.61) PPARGGRM5MEN1KMT2A

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