SCHEMBL2933258

SCHEMBL2933258

O=C(O)Nc1ccc(Oc2ccnc3[nH]c(=O)c(C(F)(F)F)nc23)c2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.73
HCK P08631 4/20 0.56
SRC P12931 4/20 0.56
MAPK12 P53778 4/20 0.56
MAPK14 Q16539 4/20 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
SCHEMBL3062162 0.88 BRAF (0.68) BRAFHCKSRCMAPK12MAPK14
SCHEMBL2928589 0.86 BRAF (0.68) BRAFHCKSRCMAPK12MAPK14
SCHEMBL2931602 0.86 BRAF (0.73) BRAFSRCMAPK12MAPK14
SCHEMBL2929840 0.85 BRAF (0.67) BRAFHCKSRCMAPK12MAPK14
SCHEMBL2935839 0.84 BRAF (1.00) BRAF
SCHEMBL2928641 0.83 BRAF (0.60) BRAFHCKSRCMAPK12MAPK14
SCHEMBL15925280 0.83 BRAF (0.81) BRAFHCKSRCMAPK12MAPK14
SCHEMBL2933845 0.80 HCK (0.65) BRAFHCKSRCMAPK12MAPK14
SCHEMBL3759372 0.77 BRAF (0.65) BRAFHCKSRCMAPK12MAPK14
SCHEMBL2928357 0.77 BRAF (1.00) BRAFHCKSRCMAPK12MAPK14

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
EP-2229391-A1 PYRIDO[2,3-B]PYRAZINE-8-SUBSTITUTED COMPOUNDS AND THEIR USE Cancer Research Technology Limited (GB) 2010-09-22 EP disclosed
WO-2009077766-A1 PYRIDO[2,3-B]PYRAZINE-8-SUBSTITUTED COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-06-25 WO disclosed