SCHEMBL759332

SCHEMBL759332

Cc1oc2ncnc(NCCc3cnc(NC(=O)Nc4ccccc4)s3)c2c1C

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 20/20 0.65
AURKB Q96GD4 10/20 0.62
NTRK2 Q16620 2/20 0.51
DDR2 Q16832 2/20 0.51
PLK4 O00444 1/20 0.51
ACOX3 O15254 1/20 0.51
MAPK13 O15264 1/20 0.51
DYRK3 O43781 1/20 0.51
ROCK2 O75116 1/20 0.51
CHEK2 O96017 1/20 0.51
CDK1 P06493 1/20 0.51
RET P07949 1/20 0.51
MET P08581 1/20 0.51
ROS1 P08922 1/20 0.51
PDGFRB P09619 1/20 0.51
KIT P10721 1/20 0.51
RPS6KB1 P23443 1/20 0.51
EPHA2 P29317 1/20 0.51
KDR P35968 1/20 0.51
FRK P42685 1/20 0.51

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
SCHEMBL759118 0.85 AURKA (0.69) AURKAAURKB
SCHEMBL759855 0.85 AURKA (0.75) AURKAAURKB
SCHEMBL759962 0.84 AURKA (0.76) AURKAAURKB
SCHEMBL763075 0.84 AURKA (0.63) AURKAAURKB
SCHEMBL13399829 0.79 AURKA (0.64) AURKAAURKBNTRK2DDR2PLK4
SCHEMBL756778 0.79 AURKA (0.74) AURKAAURKBCSF1R
SCHEMBL13242774 0.77 AURKA (1.00) AURKAAURKBNTRK2DDR2PLK4
SCHEMBL756757 0.77 AURKA (0.81) AURKAAURKB
SCHEMBL13672006 0.76 AURKA (0.65) AURKAAURKBNTRK2DDR2PLK4
SCHEMBL13399996 0.76 AURKA (0.63) AURKAAURKBNTRK2DDR2PLK4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2276346-B1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NAT HEALTH RESEARCH INSTITUTES (TW) 2016-11-23 EP disclosed
US-8138194-B2 Fused bicyclic pyrimidine compounds as aurora kinase inhibitors NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2012-03-20 US disclosed
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
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 1/4885NTRK2 4111/4885

“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.