SCHEMBL10952137

SCHEMBL10952137

CCCCCCCCCC=CCCCCCCCCOCC(COP(=O)(O)OCCNC)OC

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 8/20 0.63
▸ LPAR1 Q92633 7/20 0.63
▸ P2RY10 O00398 2/20 0.55
▸ PLA2G2C Q5R387 1/20 0.52
▸ LPAR6 P43657 3/20 0.51
▸ LPAR4 Q99677 3/20 0.51
▸ LPAR5 Q9H1C0 3/20 0.51
▸ LPAR2 Q9HBW0 3/20 0.51
▸ AKT1 P31749 4/20 0.50
▸ AKT2 P31751 3/20 0.50
▸ AKT3 Q9Y243 3/20 0.50
▸ PIK3R1 P27986 2/20 0.50
▸ PIK3CA P42336 2/20 0.50
▸ ENPP2 Q13822 2/20 0.50
▸ PLCG2 P16885 1/20 0.48
▸ GAB1 Q13480 1/20 0.48
▸ RECQL P46063 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL10948714 1.00 LPAR3 (0.63) LPAR3LPAR1P2RY10PLA2G2CLPAR6
SCHEMBL10948724 1.00 LPAR3 (0.63) LPAR3LPAR1P2RY10PLA2G2CLPAR6
SCHEMBL10952127 1.00 LPAR3 (0.63) LPAR3LPAR1P2RY10PLA2G2CLPAR6
SCHEMBL10950257 0.97 LPAR1 (0.60) LPAR3LPAR1P2RY10PLA2G2CLPAR6
SCHEMBL10950267 0.97 LPAR1 (0.60) LPAR3LPAR1P2RY10PLA2G2CLPAR6
SCHEMBL10951761 0.95 LPAR3 (0.57) LPAR3LPAR1P2RY10PLA2G2CLPAR6
SCHEMBL10950559 0.93 LPAR1 (0.58) LPAR3LPAR1PLA2G2CLPAR6LPAR4
SCHEMBL10954412 0.93 LPAR1 (0.58) LPAR3LPAR1PLA2G2CLPAR6LPAR4
SCHEMBL10951304 0.93 LPAR1 (0.58) LPAR3LPAR1PLA2G2CLPAR6LPAR4
SCHEMBL10565193 0.93 LPAR1 (0.58) LPAR3LPAR1PLA2G2CLPAR6LPAR4

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
US-4562005-A ANTITUMOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-12-31 — — US disclosed
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