SCHEMBL339429

SCHEMBL339429

CCCCCCCCCCCCCC=C1CCC(OCCOP(=O)(O)OCCCN(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 7/20 0.37
LPAR1 Q92633 5/20 0.36
LPAR2 Q9HBW0 5/20 0.36
P2RY10 O00398 5/20 0.36
SGPL1 O95470 3/20 0.33
S1PR1 P21453 2/20 0.33
GPR34 Q9UPC5 1/20 0.32

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
SCHEMBL339675 1.00 LPAR3 (0.37) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL339695 1.00 LPAR3 (0.37) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL5663655 0.86 LPAR3 (0.36) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL5673069 0.85 FABP3 (0.41) LPAR3S1PR1
SCHEMBL5672161 0.82 LPAR3 (0.34) LPAR3LPAR1LPAR2P2RY10S1PR1
SCHEMBL339933 0.80 CDC25A (0.36) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL340043 0.80 CDC25A (0.36) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL338952 0.80 CDC25A (0.36) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL339734 0.79 LPAR3 (0.32) LPAR3LPAR1LPAR2P2RY10SGPL1
SCHEMBL339773 0.79 SIGMAR1 (0.38) LPAR3LPAR1LPAR2P2RY10SGPL1

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
US-8097752-B2 Antiprotozoal ring-substituted phospholipids MAKSCIENTIFIC, LLC (US) 2012-01-17 US claimed
US-8097752-B2 Antiprotozoal ring-substituted phospholipids MAKSCIENTIFIC, LLC (US) 2012-01-17 US disclosed