SCHEMBL24327348

SCHEMBL24327348

Cn1cc(-c2nc(-c3ccc(Cl)cc3)cnc2CN2C(=O)c3ccccc3C2=O)cn1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.46
CHRM3 P20309 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
FGFR3 P22607 3/20 0.43
KDR P35968 2/20 0.43
FGFR1 P11362 2/20 0.42
FGFR2 P21802 2/20 0.42
FGFR4 P22455 1/20 0.42
ALDH1A1 P00352 2/20 0.40
CHRM5 P08912 1/20 0.40
MAPT P10636 1/20 0.40
KCNH2 Q12809 1/20 0.39
CSF1R P07333 1/20 0.39
TSHR P16473 1/20 0.39
AR P10275 1/20 0.38
EPHB4 P54760 1/20 0.38
HTR1A P08908 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL24327347 0.81 KDR (0.53) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL29498933 0.81 KDR (0.53) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL24328703 0.79 FGFR3 (0.51) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL24327370 0.79 FGFR3 (0.51) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL29498949 0.76 FGFR3 (0.56) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL24327350 0.76 FGFR3 (0.56) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL24327827 0.74 FGFR3 (0.53) FGFR3KDRFGFR1FGFR2CSF1R
SCHEMBL24328681 0.72 FGFR3 (0.49) CNR1CNR2FGFR3KDRFGFR1
SCHEMBL24328711 0.72 CHEK1 (0.52) CNR1CNR2FGFR3KDRMAPT
SCHEMBL24328713 0.72 CNR1 (0.52) CNR1CNR2FGFR3KDRKCNH2

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
WO-2022078356-A1 HETEROAROMATIC AHR INHIBITOR 山东轩竹医药科技有限公司 2022-04-21 WO disclosed