SCHEMBL30519232

SCHEMBL30519232

COC(=O)c1ncc(-c2ccc(Cl)cc2)nc1-c1cnn(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 2/20 0.46
KDR P35968 1/20 0.46
AURKA O14965 2/20 0.46
AURKB Q96GD4 2/20 0.46
CHEK1 O14757 1/20 0.44
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SYK P43405 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
CLK1 P49759 3/20 0.41
KMT2A Q03164 1/20 0.41
FGFR1 P11362 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
SCHEMBL24328682 1.00 FGFR3 (0.46) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL24328681 0.87 FGFR3 (0.49) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL24328711 0.87 CHEK1 (0.52) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL24328703 0.80 FGFR3 (0.51) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL25406013 0.79 PLA2G2A (0.47) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL29498949 0.79 FGFR3 (0.56) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL24327350 0.79 FGFR3 (0.56) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL28724019 0.77 FGFR3 (0.51) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL24327347 0.77 KDR (0.53) FGFR3KDRAURKAAURKBCHEK1
SCHEMBL24327827 0.77 FGFR3 (0.53) FGFR3KDRAURKAAURKBFGFR1

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