SCHEMBL13399987

SCHEMBL13399987

COc1cc2ncnc(NCCc3cnc(NC(=O)Nc4cccc(Br)c4)s3)c2cc1OC

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 16/20 0.83
CSF1R P07333 3/20 0.67
KDR P35968 5/20 0.63
KIT P10721 3/20 0.63
EGFR P00533 2/20 0.63
AURKB Q96GD4 7/20 0.58
NTRK2 Q16620 3/20 0.57
NTRK3 Q16288 2/20 0.57
NTRK1 P04629 2/20 0.57
FLT3 P36888 1/20 0.57
MET P08581 2/20 0.57
PDGFRB P09619 2/20 0.57
RAF1 P04049 2/20 0.57
FLT4 P35916 2/20 0.57
SRC P12931 2/20 0.57
FLT1 P17948 1/20 0.57
DDR2 Q16832 2/20 0.56
MAPK13 O15264 2/20 0.56
CDK1 P06493 2/20 0.56
PLK4 O00444 1/20 0.56

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
SCHEMBL13399788 0.90 AURKA (0.83) AURKACSF1RKDRKITAURKB
SCHEMBL13399965 0.90 AURKA (0.83) AURKACSF1RKDRKITEGFR
SCHEMBL13427680 0.90 AURKA (0.83) AURKACSF1RKDRKITAURKB
SCHEMBL13399784 0.88 AURKA (0.84) AURKACSF1RKDRKITAURKB
SCHEMBL13399796 0.83 AURKA (0.84) AURKACSF1RKDREGFRAURKB
SCHEMBL13399787 0.80 AURKA (0.74) AURKACSF1RKDRKITAURKB
SCHEMBL13399792 0.78 AURKA (0.77) AURKACSF1RKDREGFRAURKB
SCHEMBL31067695 0.78 KDR (1.00) KDRKITEGFRMETPDGFRB
SCHEMBL13430255 0.77 KDR (0.61) AURKAKDRKITEGFRMET
SCHEMBL13399781 0.76 AURKA (0.74) AURKACSF1RKDRKITEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006252-B2 Fused multicyclic compounds as protein kinase inhibitors NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2015-04-14 US disclosed
US-9006252-B2 Fused multicyclic compounds as protein kinase inhibitors NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2015-04-14 US disclosed
EP-2331530-B1 FUSED MULTICYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS NAT HEALTH RESEARCH INSTITUTES (CN) 2013-08-21 EP disclosed
US-20100081675-A1 FUSED MULTICYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-04-01 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-20100081675-A1 FUSED MULTICYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS AURKC, AURKA, AURKB AURKA 2/4885CSF1R 3375/4885KDR 2503/4885

“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.