SCHEMBL9016524

SCHEMBL9016524

CCc1nc2c(C)c(C)c(C)nc2n1-c1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.41
ESR2 Q92731 1/20 0.39
AGTR1 P30556 1/20 0.38
GRIA2 P42262 1/20 0.38
GRIA4 P48058 1/20 0.38
SLC6A9 P48067 1/20 0.37
NR3C1 P04150 1/20 0.36
KDM5A P29375 1/20 0.35
ACHE P22303 1/20 0.35
TRPA1 O75762 1/20 0.34
XDH P47989 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA2 P47869 1/20 0.34

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
SCHEMBL9016422 0.92 PPARG (0.48) PPARGESR2AGTR1GRIA2GRIA4
SCHEMBL9016466 0.91 APLNR (0.44) PPARGESR2AGTR1ACHEAPLNR
SCHEMBL9016540 0.90 PPARG (0.39) PPARGESR2AGTR1GRIA2GRIA4
SCHEMBL9016411 0.86 SLC6A9 (0.40) PPARGESR2GRIA2GRIA4SLC6A9
SCHEMBL9016415 0.84 AGTR1 (0.46) AGTR1
SCHEMBL9016542 0.83 PPARG (0.46) PPARGESR2AGTR1GRIA2GRIA4
SCHEMBL9016396 0.81 APLNR (0.42) PPARGESR2AGTR1GRIA2GRIA4
SCHEMBL9016476 0.81 ESR2 (0.36) PPARGESR2AGTR1NR3C1TRPA1
SCHEMBL7388926 0.79 F10 (0.38) PPARGAGTR1
SCHEMBL9016423 0.79 PPARG (0.46) PPARGESR2AGTR1SLC6A9NR3C1

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
US-5554757-A Process for the preparation of imidazopyridine derivatives, and intermediates therefore EISAI CO., LTD. (JP) 1996-09-10 US disclosed