SCHEMBL3177191

SCHEMBL3177191

Nc1cc(Oc2ccc(NC(=O)Nc3ccc(CN4CCCCC4)c(C(F)(F)F)c3)cc2)ncn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 6/20 0.68
KDR P35968 6/20 0.68
ABL1 P00519 5/20 0.68
BRAF P15056 4/20 0.68
MAPK14 Q16539 3/20 0.68
TNNI3K Q59H18 3/20 0.68
MKNK2 Q9HBH9 3/20 0.68
CDK2 P24941 2/20 0.68
CDK8 P49336 2/20 0.68
HCK P08631 2/20 0.68
AXL P30530 2/20 0.68
FLT3 P36888 2/20 0.68
MERTK Q12866 2/20 0.68
MKNK1 Q9BUB5 2/20 0.68
FGFR4 P22455 2/20 0.68
DDR1 Q08345 2/20 0.68
FGFR1 P11362 2/20 0.68
RET P07949 2/20 0.68
STK25 O00506 1/20 0.68
CIT O14578 1/20 0.68

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
SCHEMBL4762420 0.92 SRC (0.81) SRCKDRABL1BRAFMAPK14
SCHEMBL29827937 0.92 CDK2 (0.75) SRCKDRABL1BRAFMAPK14
SCHEMBL4941049 0.92 SRC (0.66) SRCKDRABL1BRAFMAPK14
SCHEMBL4769220 0.92 CDK2 (0.75) SRCKDRABL1BRAFMAPK14
SCHEMBL3166521 0.90 KDR (0.69) SRCKDRABL1BRAFMAPK14
SCHEMBL13991087 0.90 KDR (0.70) SRCKDRABL1BRAFMAPK14
SCHEMBL4936999 0.89 SRC (0.68) SRCKDRABL1BRAFMAPK14
SCHEMBL4763945 0.88 KDR (0.86) SRCKDRABL1BRAFMAPK14
SCHEMBL4936158 0.88 KDR (0.70) SRCKDRABL1BRAFMAPK14
SCHEMBL4769373 0.85 KDR (0.51) SRCKDRABL1BRAFMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1511730-B1 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2008-12-10 EP claimed
US-7652022-B2 N-(4-(4-(4-hydroxyphenylamino)-pyrimidin-6-yl)-oxyphenyl)-N'-(3-trifluoromethylphenyl)-urea; NOVARTIS AG (CH) 2010-01-26 US disclosed
EP-1511730-B8 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2009-04-08 EP disclosed
EP-1511730-B1 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2008-12-10 EP disclosed
US-20060128734-A1 Diaryl urea derivatives useful for the treatment of protein kinase dependent diseases FLOERSHEIMER ANDREAS 2006-06-15 US disclosed
EP-1511730-A2 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES Novartis AG (CH) 2005-03-09 EP disclosed
WO-2003099771-A2 DIARYL UREA DERIVATIVES USEFUL FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2003-12-04 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-20060128734-A1 Diaryl urea derivatives useful for the treatment of protein kinase dependent diseases UCK2, PRKDC, PRKACA SRC 849/4885KDR 3898/4885ABL1 147/4885

“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.