SCHEMBL4510958

SCHEMBL4510958

CCN1C(=O)C(C)(C)c2cc3nc(-c4n[nH]c5cc(/C=C/c6ccc(C(F)(F)F)cc6)ccc45)[nH]c3cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.49
AURKB Q96GD4 3/20 0.49
CHEK1 O14757 7/20 0.38
FLT3 P36888 4/20 0.38
CDK2 P24941 3/20 0.38
SRC P12931 2/20 0.38
KDR P35968 2/20 0.38
GSK3B P49841 2/20 0.38
FGFR1 P11362 3/20 0.38
FLT1 P17948 2/20 0.38
JAK2 O60674 4/20 0.35
TYK2 P29597 4/20 0.35
JAK3 P52333 4/20 0.35
PDPK1 O15530 2/20 0.35
CLK4 Q9HAZ1 2/20 0.35
PLK4 O00444 1/20 0.35
CHUK O15111 1/20 0.35
ROCK2 O75116 1/20 0.35
MAP4K4 O95819 1/20 0.35
PAK4 O96013 1/20 0.35

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
SCHEMBL4510962 1.00 AURKA (0.49) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4501399 0.91 AURKA (0.51) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4501403 0.91 AURKA (0.51) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4507275 0.90 AURKA (0.51) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4507269 0.90 AURKA (0.51) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4504808 0.90 AURKA (0.51) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4504801 0.90 AURKA (0.51) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4500983 0.88 AURKA (0.49) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4500978 0.88 AURKA (0.49) AURKAAURKBCHEK1FLT3CDK2
SCHEMBL4505049 0.88 AURKB (0.49) AURKAAURKBCHEK1FLT3CDK2

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
US-20090291968-A1 SUBSTITUTED INDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS GEORGES GUY 2009-11-26 US claimed
US-20090291968-A1 SUBSTITUTED INDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS GEORGES GUY 2009-11-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090291968-A1 SUBSTITUTED INDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS CYP3A43, CYP3A5, CYP3A7 AURKA 1558/4885AURKB 2087/4885CHEK1 1412/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.