SCHEMBL2364332

SCHEMBL2364332

Cn1cc(-n2ccc(=O)c(Cc3cccc(-c4ncc(O[C@H]5CC[C@@H](O)CC5)cn4)c3)n2)cn1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IRAK1 P51617 7/20 0.38
AXL P30530 8/20 0.37
MERTK Q12866 8/20 0.37
TYRO3 Q06418 6/20 0.37
IRAK4 Q9NWZ3 3/20 0.34
FGFR1 P11362 1/20 0.34
FGFR3 P22607 1/20 0.34
MET P08581 1/20 0.34
NQO2 P16083 1/20 0.34

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
SCHEMBL13274737 1.00 IRAK1 (0.38) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL2364333 1.00 IRAK1 (0.38) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL2264457 0.91 AXL (0.34) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL2266939 0.91 FGFR1 (0.40) IRAK1AXLMERTKIRAK4FGFR1
SCHEMBL13274930 0.90 AXL (0.35) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL13274931 0.90 AXL (0.35) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL13274932 0.90 AXL (0.35) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL2364945 0.89 FGFR1 (0.39) IRAK1AXLMERTKIRAK4FGFR1
SCHEMBL13275028 0.88 IRAK1 (0.39) IRAK1AXLMERTKTYRO3IRAK4
SCHEMBL13274623 0.88 IRAK1 (0.39) IRAK1AXLMERTKTYRO3IRAK4

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
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US 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 IRAK1 584/4885AXL 426/4885MERTK 13/4885

“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.