SCHEMBL10164577

SCHEMBL10164577

COCCCCCc1cccc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 12/20 0.71
LPL P06858 11/20 0.71
DGAT1 O75907 1/20 0.34
F11 P03951 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 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
SCHEMBL16768507 0.86 LIPG (0.78) LIPGLPLDGAT1F11
SCHEMBL22748422 0.85 LIPG (0.97) LIPGLPLTDP1L3MBTL1
SCHEMBL19026951 0.82 LIPG (0.56) LIPGLPL
SCHEMBL14750160 0.81 LIPG (0.91) LIPGLPLF11
SCHEMBL31150275 0.81 LPL (0.48) LIPGLPL
SCHEMBL16936864 0.80 LIPG (0.74) LIPGLPLF11CYP4F2CYP4A11
SCHEMBL17927354 0.80 LIPG (0.74) LIPGLPLDGAT1F11
SCHEMBL1744642 0.80 LIPG (0.60) LIPGLPLDGAT1F11
SCHEMBL2670630 0.78 LIPG (0.53) LIPGLPLF11HDAC1HDAC6
SCHEMBL22379978 0.78 LIPG (0.67) LIPGLPLDGAT1F11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846927-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-09-30 US disclosed
US-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2013-06-27 US disclosed
US-8389541-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-03-05 US disclosed
US-20120108628-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2012-05-03 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 (2 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-20130165477-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET LIPG 933/4885LPL 3131/4885DGAT1 4197/4885
US-20120108628-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET LIPG 933/4885LPL 3131/4885DGAT1 4197/4885

“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.