SCHEMBL2484026

SCHEMBL2484026

CCCCCOP(=O)(OCCCCC)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.60
LPAR2 Q9HBW0 6/20 0.60
LPAR1 Q92633 6/20 0.60
CYP3A4 P08684 2/20 0.52
LPAR5 Q9H1C0 1/20 0.42
TSHR P16473 1/20 0.41
BTN3A1 O00481 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
SCHEMBL4183341 0.98 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL2480132 0.98 LPAR3 (0.63) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL9817809 0.96 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL9359795 0.96 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL4189844 0.96 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL9817835 0.96 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL9817795 0.96 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL20819185 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL4173775 0.93 CYP3A4 (0.57) LPAR3LPAR2LPAR1CYP3A4TSHR
SCHEMBL1582975 0.90 LPAR3 (0.67) LPAR3LPAR2LPAR1CYP3A4LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376543-A1 PROCESS FOR PREPARING A FUNCTIONALIZED DIENE ELASTOMER, SUCH AS A POLYBUTADIENE Société de Technologie MICHELIN (FR) 2011-10-19 EP disclosed
EP-2376544-A1 METHOD FOR PREPARING A FUNCTIONALISED DIENE ELASTOMER SUCH AS POLYBUTADIENE Société de Technologie MICHELIN (FR) 2011-10-19 EP disclosed