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SCHEMBL10336288

SCHEMBL10336288

C=C(C)C(=O)OC(CCCCCOP(=O)(O)O)OC(=O)C(=C)C

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 10/20 0.46
▸ LPAR2 Q9HBW0 6/20 0.46
▸ LPAR1 Q92633 6/20 0.46
▸ SMPD1 P17405 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ LPAR5 Q9H1C0 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
SCHEMBL9638935 0.94 LPAR3 (0.41) LPAR3LPAR2LPAR1SMPD1TSHR
SCHEMBL2996070 0.93 SMPD1 (0.46) LPAR3LPAR2LPAR1SMPD1TSHR
SCHEMBL3975681 0.87 LPAR3 (0.35) LPAR3LPAR2LPAR1TSHR
SCHEMBL28634001 0.84 LPAR3 (0.46) LPAR3LPAR2LPAR1SMPD1TSHR
SCHEMBL23611255 0.83 LPAR3 (0.53) LPAR3LPAR2LPAR1SMPD1TSHR
SCHEMBL1890625 0.83 LPAR3 (0.57) LPAR3LPAR2LPAR1SMPD1TSHR
SCHEMBL15166 0.79 TSHR (0.62) LPAR3LPAR2LPAR1TSHR
SCHEMBL1653308 0.79 TSHR (0.62) LPAR3LPAR2LPAR1TSHR
SCHEMBL345787 0.79 TSHR (0.62) LPAR3LPAR2LPAR1TSHR
SCHEMBL1651991 0.79 TSHR (0.62) LPAR3LPAR2LPAR1TSHR

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-0355157-A1 ADHESION PROMOTERS FOR THIOLENE ADHESIVE FORMULATIONS. LOCTITE CORP (US) 1990-02-28 — — EP claimed
WO-1989006666-A1 ADHESION PROMOTERS FOR THIOLENE ADHESIVE FORMULATIONS LOCTITE CORPORATION (US) 1989-07-27 — — WO claimed