SCHEMBL8796454

SCHEMBL8796454

O=C1c2c[n+]([O-])ccc2-c2n[nH]c3cccc1c23

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 6/20 0.67
▸ KDR P35968 5/20 0.67
▸ MAPK8 P45983 3/20 0.67
▸ MAPK9 P45984 3/20 0.67
▸ KIT P10721 3/20 0.67
▸ LCK P06239 3/20 0.67
▸ CSF1R P07333 3/20 0.67
▸ FGFR1 P11362 3/20 0.67
▸ ROCK1 Q13464 3/20 0.67
▸ MAPK10 P53779 2/20 0.67
▸ FLT3 P36888 2/20 0.67
▸ EIF2AK2 P19525 2/20 0.67
▸ MAPK12 P53778 2/20 0.67
▸ PLK4 O00444 2/20 0.67
▸ AURKA O14965 2/20 0.67
▸ DAPK3 O43293 2/20 0.67
▸ PRKD3 O94806 2/20 0.67
▸ MAP4K4 O95819 2/20 0.67
▸ NTRK1 P04629 2/20 0.67
▸ CDK1 P06493 2/20 0.67

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
SCHEMBL29693577 0.81 ALDH1A1 (1.00) TTKKDRMAPK8MAPK9KIT
SCHEMBL29941507 0.81 ALDH1A1 (1.00) TTKKDRMAPK8MAPK9KIT
SCHEMBL170980 0.81 ALDH1A1 (1.00) TTKKDRMAPK8MAPK9KIT
SCHEMBL8866586 0.74 TTK (0.73) TTKKDRMAPK8MAPK9KIT
SCHEMBL7817760 0.73 PIM1 (0.72) TTKKDRMAPK8MAPK9KIT
SCHEMBL7830253 0.72 MEN1 (0.52) MAPK1KDM4ENPC1ALDH1A1MEN1
SCHEMBL7810309 0.70 TTK (0.72) TTKKDRMAPK8MAPK9KIT
SCHEMBL9201258 0.70 MEN1 (0.67) TTKKDRMAPK8MAPK9KIT
SCHEMBL8796647 0.70 MEN1 (0.67) TTKKDRMAPK8MAPK9KIT
SCHEMBL8336855 0.69 CDK2 (0.65) TTKKDRMAPK8MAPK9KIT

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
EP-0750619-A1 HETERO-ANNULATED INDAZOLES BOEHRINGER MANNHEIM ITALIA S.p.A. (IT) 1997-01-02 — — EP disclosed
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