SCHEMBL780264

SCHEMBL780264

CC(C)(C)OC(=O)n1cc(-c2ccc3nc(NCc4cccc(Cl)c4)cnc3c2)cn1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCD O00767 2/20 0.39
FYN P06241 4/20 0.39
MAPK1 P28482 1/20 0.39
AURKB Q96GD4 1/20 0.39
EGLN1 Q9GZT9 1/20 0.38
MAP4K4 O95819 1/20 0.38
BRD4 O60885 2/20 0.38
CCNT1 O60563 2/20 0.38
TP53 P04637 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
PIK3CA P42336 1/20 0.37
TTK P33981 1/20 0.37
ACHE P22303 1/20 0.37
ROCK2 O75116 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 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
SCHEMBL781898 0.91 MAPK1 (0.47) SCDMAPK1AURKBPDGFRBPDGFRA
SCHEMBL780128 0.83 PFKFB3 (0.38) SCDMAPK1TTKROCK2
SCHEMBL780984 0.81 IDO1 (0.39) SCDEGLN1BRD4TP53ROCK2
SCHEMBL27868799 0.79 BRD4 (0.44) SCDFYNMAP4K4BRD4PDGFRB
SCHEMBL16168351 0.78 FYN (0.40) SCDFYNMAP4K4BRD4PDGFRB
SCHEMBL16161585 0.77 MAPK1 (0.48) MAPK1AURKBPDGFRBPDGFRAPIK3CA
Tert-Butyl Formate SCHEMBL27851805 0.77 FYN (0.39) SCDFYNMAP4K4BRD4CCNT1
SCHEMBL23804708 0.77 SCD (0.49) SCDEGLN1TP53ROCK2
Tert-Butyl Formate SCHEMBL27851803 0.76 ROCK2 (0.45) FYNMAP4K4PDGFRBPDGFRAROCK2
SCHEMBL781950 0.76 SCD (0.40) SCDMAPK1AURKBROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435423-B1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P70S6 KINASE SENTINEL ONCOLOGY LTD (GB) 2014-10-15 EP disclosed
US-8716473-B2 Substituted benzotriazines and quinoxalines as inhibitors of P7OS6 kinase SENTINEL ONCOLOGY LIMITED (GB) 2014-05-06 US disclosed
US-8716473-B2 Substituted benzotriazines and quinoxalines as inhibitors of P7OS6 kinase SENTINEL ONCOLOGY LIMITED (GB) 2014-05-06 US disclosed
US-8716473-B2 Substituted benzotriazines and quinoxalines as inhibitors of P7OS6 kinase SENTINEL ONCOLOGY LIMITED (GB) 2014-05-06 US disclosed
US-20120071478-A1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P7OS6 KINASE SENTINEL ONCOLOGY LIMITED (GB) 2012-03-22 US disclosed
US-20120071478-A1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P7OS6 KINASE SENTINEL ONCOLOGY LIMITED (GB) 2012-03-22 US disclosed
US-20120071478-A1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P7OS6 KINASE SENTINEL ONCOLOGY LIMITED (GB) 2012-03-22 US disclosed
WO-2010136755-A1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P7OS6 KINASE SENTINEL ONCOLOGY LIMITED (GB) 2010-12-02 WO disclosed
WO-2010136755-A1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P7OS6 KINASE SENTINEL ONCOLOGY LIMITED (GB) 2010-12-02 WO 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-20120071478-A1 SUBSTITUTED BENZOTRIAZINES AND QUINOXALINES AS INHIBITORS OF P7OS6 KINASE CDK1, CDK2, CDK6 SCD 4744/4885FYN 261/4885MAPK1 64/4885

“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.