SCHEMBL29601467

SCHEMBL29601467

Cn1cc(-c2nc(N)cc(-c3ccc(Cl)cc3)n2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 1/20 0.48
KDR P35968 1/20 0.48
HRH4 Q9H3N8 2/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
KCNH2 Q12809 1/20 0.43
CHEK1 O14757 1/20 0.42
PIK3CD O00329 1/20 0.42
PIK3CA P42336 1/20 0.42
PIK3CB P42338 1/20 0.42
PI4KA P42356 1/20 0.42
PIK3CG P48736 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
FLT3 P36888 2/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL24327356 1.00 FGFR3 (0.48) FGFR3KDRHRH4ADORA2AADORA1
SCHEMBL25458389 0.86 KDR (0.50) FGFR3KDRHRH4KCNH2CHEK1
SCHEMBL30085870 0.86 KDR (0.50) FGFR3KDRHRH4KCNH2CHEK1
SCHEMBL30085837 0.83 FGFR3 (0.48) FGFR3KDRHRH4KCNH2CHEK1
SCHEMBL25458392 0.83 FGFR3 (0.48) FGFR3KDRHRH4KCNH2CHEK1
SCHEMBL14656027 0.82 PIK3CD (0.45) FGFR3KDRCHEK1PIK3CDPIK3CA
SCHEMBL25459484 0.81 ADORA3 (0.48) FGFR3KDRKCNH2CHEK1FLT3
SCHEMBL29020125 0.79 CHEK1 (0.53) FGFR3KDRCHEK1MKNK1MKNK2
SCHEMBL28761423 0.78 FGFR3 (0.46) FGFR3KDRHRH4KCNH2CHEK1
SCHEMBL30085456 0.78 HRH4 (0.64) HRH4PIK3CAHTR6HRH3LRRK2

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-114369097-B Heteroaromatic AhR inhibitors 山东轩竹医药科技有限公司 2023-07-14 CN disclosed
CN-114369097-A Heteroaromatic AhR inhibitors 山东轩竹医药科技有限公司 2022-04-19 CN disclosed