SCHEMBL2222997

SCHEMBL2222997

Cn1cc(-n2ccc(=O)c(Cc3cccc(-c4ncc(OCc5ccsn5)cn4)c3)n2)cn1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.33
FYN P06241 1/20 0.33
HSD17B13 Q7Z5P4 1/20 0.33
ALKBH1 Q13686 3/20 0.32
FGFR1 P11362 1/20 0.32
FGFR3 P22607 1/20 0.32
ENPP2 Q13822 1/20 0.32
IRAK4 Q9NWZ3 3/20 0.31
IRAK1 P51617 2/20 0.31
NQO2 P16083 1/20 0.31
F2RL3 Q96RI0 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
SCHEMBL2221907 0.89 ALKBH1 (0.41) HSD17B13ALKBH1FGFR1FGFR3
SCHEMBL2364978 0.88 SNRNP200 (0.36) METHSD17B13ALKBH1ENPP2IRAK4
SCHEMBL13274653 0.87 IRAK1 (0.39) METHSD17B13ALKBH1FGFR1FGFR3
SCHEMBL164227 0.87 BRD4 (0.37) METFYNHSD17B13FGFR3ENPP2
SCHEMBL2266318 0.87 USP1 (0.38) METFYNHSD17B13ALKBH1FGFR1
SCHEMBL255611 0.86 MET (0.41) METHSD17B13ALKBH1FGFR1FGFR3
SCHEMBL2264690 0.85 MET (0.39) METALKBH1
SCHEMBL2221516 0.85 MET (0.34) METHSD17B13ALKBH1IRAK4IRAK1
SCHEMBL2268190 0.85 PPARG (0.37) METHSD17B13ENPP2IRAK4IRAK1
SCHEMBL2363122 0.84 MET (0.34) METFYNHSD17B13ENPP2IRAK4

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 2/4885FYN 55/4885HSD17B13 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.