SCHEMBL780389

SCHEMBL780389

Clc1cccc(CNc2cnc3cc(Br)ccc3n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.50
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
PDE5A O76074 1/20 0.44
APP P05067 2/20 0.43
HTT P42858 2/20 0.41
RAF1 P04049 1/20 0.41
MAPK1 P28482 1/20 0.41
EGFR P00533 1/20 0.41
TMIGD3 P0DMS9 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
FYN P06241 2/20 0.40
ABL1 P00519 1/20 0.40
SRC P12931 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL18171881 0.85 PDGFRB (0.61) MAP4K4PDGFRBPDGFRAPDE5AHTT
SCHEMBL13050083 0.85 MAP4K4 (0.50) MAP4K4PDGFRBPDGFRAHDAC3HDAC1
SCHEMBL780564 0.80 PDGFRB (0.61) PDGFRBPDGFRAPDE5AHTTMAPK1
SCHEMBL780558 0.78 ROCK2 (0.51) MAP4K4PDGFRBPDGFRAPDE5AFYN
SCHEMBL781915 0.78 KDM4E (0.47) PDGFRBPDGFRAHTTMAPK1LMNA
SCHEMBL782040 0.77 HRH4 (0.46) MAP4K4PDGFRBPDGFRA
SCHEMBL21842582 0.76 MAP4K4 (0.44) MAP4K4PDGFRBPDGFRAHDAC3HDAC1
SCHEMBL1530816 0.75 PDGFRB (0.55) PDGFRBPDGFRAEGFRCLK4
SCHEMBL3908347 0.74 PDGFRB (0.75) PDGFRBPDGFRAHDAC6APPHTT
SCHEMBL18895168 0.73 HTT (0.74) PDE5AHTTRAF1MAPK1EGFR

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 10 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
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
CN-102459234-A Substituted benzotriazines and quinoxalines as P70S6 kinase inhibitors SENTINEL ONCOLOGY LTD 2012-05-16 CN 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

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 MAP4K4 81/4885PDGFRB 1860/4885PDGFRA 1632/4885

“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.