SCHEMBL763953

SCHEMBL763953

CNc1oc(-c2ccccc2)c(-c2ccccc2)c1C(=N)NCCc1ccc(NC(=O)Nc2ccccc2)nc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AURKA O14965 15/20 0.47
AURKB Q96GD4 5/20 0.39
DGAT1 O75907 3/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL764300 0.84 AURKA (0.47) AURKAAURKBNPC1RAB9A
SCHEMBL763184 0.75 AURKA (0.52) AURKAAURKBNPC1RAB9A
SCHEMBL757517 0.74 AURKA (0.83) AURKAAURKB
SCHEMBL13632595 0.71 AURKA (0.38) AURKA
SCHEMBL764302 0.71 FPR2 (0.43) AURKANPC1RAB9A
SCHEMBL763384 0.70 CNR1 (0.46) AURKANPC1RAB9A
SCHEMBL764012 0.66 AURKA (0.49) AURKAAURKBNPC1RAB9A
SCHEMBL763116 0.66 CNR1 (0.45) AURKANPC1RAB9A
SCHEMBL735226 0.64 AURKA (1.00) AURKAAURKB
SCHEMBL757825 0.63 AURKA (0.85) AURKAAURKB

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-8138194-B2 Fused bicyclic pyrimidine compounds as aurora kinase inhibitors NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2012-03-20 US disclosed
US-20090275533-A1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-11-05 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-20090275533-A1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS AURKB, AURKA, AURKC AURKA 2/4885AURKB 1/4885DGAT1 4379/4885

“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.