SCHEMBL3948424

SCHEMBL3948424

CCCCCCCC(=O)OCC1COC(C)(CCCCCCC)O1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.48
LPAR3 Q9UBY5 3/20 0.48
ENPP2 Q13822 2/20 0.47
DGKA P23743 1/20 0.43

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
SCHEMBL19652559 0.93 LPAR1 (0.46) LPAR1LPAR3ENPP2
SCHEMBL17772555 0.91 LPAR1 (0.46) LPAR1LPAR3ENPP2
SCHEMBL17772529 0.90 DGKA (0.46) LPAR1LPAR3ENPP2DGKA
SCHEMBL14725883 0.90 LPAR1 (0.45) LPAR1LPAR3ENPP2
SCHEMBL19652555 0.90 DGKA (0.46) LPAR1LPAR3ENPP2DGKA
SCHEMBL17772536 0.90 PRKCA (0.47) LPAR1LPAR3ENPP2DGKA
SCHEMBL17772527 0.90 PRKCA (0.47) LPAR1LPAR3ENPP2DGKA
SCHEMBL19652560 0.90 PRKCA (0.45) LPAR1LPAR3ENPP2
SCHEMBL17772532 0.90 DGKA (0.46) LPAR1LPAR3ENPP2DGKA
SCHEMBL17772550 0.90 PRKCA (0.47) LPAR1LPAR3ENPP2DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046147-B1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-05-01 EP disclosed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US disclosed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US disclosed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US disclosed
EP-2046147-A1 METHOD OF USING ORGANIC COMPOUNDS Givaudan SA (CH) 2009-04-15 EP disclosed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 WO disclosed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 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-20090311403-A1 Method of Using Organic Compounds MGLL, GK, LIPC LPAR1 2019/4885LPAR3 1772/4885ENPP2 3891/4885

“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.