SCHEMBL2264978

SCHEMBL2264978

COCCCc1cnc(-c2cccc(Cc3nn(-c4cnn(C)c4)ccc3=O)c2)nc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.37
IGF1R P08069 6/20 0.36
HSD17B13 Q7Z5P4 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
HDAC6 Q9UBN7 1/20 0.32
ENPP2 Q13822 1/20 0.32
IRAK4 Q9NWZ3 3/20 0.31
IRAK1 P51617 2/20 0.31
NTRK1 P04629 1/20 0.31
PDGFRB P09619 1/20 0.31
KIT P10721 1/20 0.31
FGFR1 P11362 1/20 0.31
FGFR3 P22607 1/20 0.31
FLT3 P36888 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL12517647 0.91 RARB (0.36) HSD17B13ENPP2IRAK4IRAK1FYN
SCHEMBL2221574 0.90 IRAK1 (0.39) METHSD17B13PPARGPPARAENPP2
SCHEMBL2262998 0.90 HSD17B13 (0.38) METIGF1RHSD17B13PPARGPPARA
SCHEMBL255605 0.89 MET (0.44) METIGF1RPPARGPPARAKIT
SCHEMBL2268987 0.89 HSD17B13 (0.37) METIGF1RHSD17B13PPARGPPARA
SCHEMBL2221585 0.88 MET (0.37) METIGF1RHSD17B13ENPP2IRAK4
SCHEMBL2265280 0.87 IRAK4 (0.36) METIGF1RIRAK4IRAK1NTRK1
SCHEMBL255611 0.87 MET (0.41) METHSD17B13PPARGPPARAENPP2
SCHEMBL13274509 0.87 MET (0.36) METIGF1RIRAK4IRAK1
SCHEMBL13274689 0.87 IGF1R (0.40) METIGF1RPPARGPPARAHDAC6

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 8 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
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP 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
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 MET 2/4885IGF1R 152/4885HSD17B13 3914/4885

“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.