SCHEMBL6037744

SCHEMBL6037744

COC(=O)CCc1cccc(CC(CCCc2ccccc2)C(O)c2cc(OC)c(C)c(OC)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 19/20 0.69
TRPV1 Q8NER1 1/20 0.41

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
SCHEMBL2476173 1.00 LPAR1 (0.69) LPAR1TRPV1
SCHEMBL972590 1.00 LPAR1 (0.69) LPAR1TRPV1
SCHEMBL970295 0.92 LPAR1 (0.78) LPAR1TRPV1
SCHEMBL970293 0.92 LPAR1 (0.78) LPAR1TRPV1
SCHEMBL968665 0.87 LPAR1 (0.86) LPAR1
SCHEMBL968667 0.87 LPAR1 (0.86) LPAR1
SCHEMBL970091 0.87 LPAR1 (0.86) LPAR1TRPV1
SCHEMBL970090 0.87 LPAR1 (0.86) LPAR1TRPV1
SCHEMBL12917807 0.86 LPAR1 (0.85) LPAR1
SCHEMBL12917806 0.86 LPAR1 (0.85) LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1695955-A1 COMPOUNDS HAVING LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISM AND USES THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-08-30 EP disclosed