SCHEMBL2939669

SCHEMBL2939669

COc1ccc(-c2ccnc(Nc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 10/20 0.60
BCR P11274 4/20 0.60
PDGFRB P09619 4/20 0.58
PDGFRA P16234 4/20 0.58
EGFR P00533 1/20 0.58
PRKCA P17252 1/20 0.58
BRAF P15056 6/20 0.56
KDR P35968 3/20 0.56
TEK Q02763 2/20 0.56
LCK P06239 2/20 0.55
BTK Q06187 1/20 0.55
CSF1R P07333 3/20 0.54
KIT P10721 4/20 0.54
LDLR P01130 1/20 0.54
PCSK9 Q8NBP7 1/20 0.54
AURKA O14965 1/20 0.54
SRC P12931 1/20 0.54
MAPK14 Q16539 1/20 0.54
AURKB Q96GD4 1/20 0.54
TPX2 Q9ULW0 1/20 0.54

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
SCHEMBL2939269 0.93 ABL1 (0.61) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2945359 0.91 ABL1 (0.70) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2941616 0.87 KIT (0.61) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL1408815 0.87 ABL1 (0.77) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL30899721 0.87 ABL1 (0.67) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2941693 0.87 ABL1 (0.67) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2940451 0.86 ABL1 (0.59) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2942574 0.86 ABL1 (0.55) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2946486 0.85 ABL1 (0.59) ABL1BCRPDGFRBPDGFRAEGFR
SCHEMBL2940107 0.85 KDR (0.57) ABL1BCRPDGFRBPDGFRAEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1635835-B1 2-AMINOPYRIMIDINE DERIVATIVES AS RAF KINASE INHIBITORS NOVARTIS AG (CH) 2010-01-06 EP claimed
EP-1635835-B1 2-AMINOPYRIMIDINE DERIVATIVES AS RAF KINASE INHIBITORS NOVARTIS AG (CH) 2010-01-06 EP disclosed
US-20060293340-A1 2-Aminopyrimidine derivatives as raf kinase inhibitors NOVARTIS AG (CH) 2006-12-28 US disclosed
EP-1635835-A1 2-AMINOPYRIMIDINE DERIVATIVES AS RAF KINASE INHIBITORS Novartis AG (CH) 2006-03-22 EP disclosed
WO-2004110452-A1 2-AMINOPYRIMIDINE DERIVATIVES AS RAF KINASE INHIBITORS NOVARTIS AG (CH) 2004-12-23 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-20060293340-A1 2-Aminopyrimidine derivatives as raf kinase inhibitors BRAF, RAF1, ARAF ABL1 72/4885BCR 1002/4885PDGFRB 913/4885

“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.