SCHEMBL2265280

SCHEMBL2265280

COCCN(C)c1cnc(-c2cccc(Cc3nn(-c4cnn(C)c4)ccc3=O)c2)nc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 4/20 0.36
IRAK1 P51617 3/20 0.36
KDR P35968 3/20 0.36
FGFR1 P11362 3/20 0.36
FGFR3 P22607 3/20 0.36
FGFR2 P21802 2/20 0.36
FGFR4 P22455 2/20 0.36
USP1 O94782 1/20 0.35
MET P08581 6/20 0.34
IGF1R P08069 5/20 0.34
NTRK1 P04629 1/20 0.33
PDGFRB P09619 1/20 0.33
KIT P10721 1/20 0.33
FLT3 P36888 1/20 0.33

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
SCHEMBL2223764 0.91 IRAK4 (0.36) IRAK4IRAK1METIGF1R
SCHEMBL255605 0.88 MET (0.44) METIGF1RKIT
SCHEMBL2264978 0.87 MET (0.37) IRAK4IRAK1FGFR1FGFR3MET
SCHEMBL2262998 0.87 HSD17B13 (0.38) IRAK4IRAK1FGFR1FGFR3MET
SCHEMBL255611 0.86 MET (0.41) KDRFGFR1FGFR3FGFR2MET
SCHEMBL13274509 0.86 MET (0.36) IRAK4IRAK1USP1METIGF1R
SCHEMBL2221585 0.86 MET (0.37) IRAK4IRAK1METIGF1R
SCHEMBL2221123 0.85 AURKA (0.40) IRAK4IRAK1METIGF1R
SCHEMBL12516405 0.85 MET (0.40) IRAK4IRAK1METIGF1R
SCHEMBL2276244 0.85 MET (0.40) IRAK4IRAK1MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP claimed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US claimed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO claimed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 IRAK4 629/4885IRAK1 584/4885KDR 131/4885

“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.