SCHEMBL28823130

SCHEMBL28823130

CCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O.[Zn]

nearest known ligand 0.95

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 14/20 0.95
▸ LPAR2 Q9HBW0 10/20 0.95
▸ LPAR1 Q92633 7/20 0.95
▸ LPAR5 Q9H1C0 1/20 0.58
▸ CYP3A4 P08684 1/20 0.50
▸ SMPD1 P17405 1/20 0.48

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
Phosphoric Acid Monotetradecyl Ester SCHEMBL1005394 1.00 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL60047 1.00 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5CYP3A4
Phosphoric Acid Monododecyl Ester SCHEMBL1004420 1.00 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5CYP3A4
Hexadecyl Dihydrogen Phosphate SCHEMBL483431 1.00 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL9339267 1.00 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5CYP3A4
Hexadecyl Dihydrogen Phosphate SCHEMBL23121443 0.98 LPAR3 (0.91) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL9417726 0.98 LPAR3 (0.91) LPAR3LPAR2LPAR1LPAR5CYP3A4
Phosphoric Acid Monododecyl Ester SCHEMBL9417731 0.98 LPAR3 (0.91) LPAR3LPAR2LPAR1LPAR5CYP3A4
Hexadecyl Dihydrogen Phosphate SCHEMBL340624 0.98 LPAR3 (0.91) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL9417722 0.98 LPAR3 (0.91) LPAR3LPAR2LPAR1LPAR5CYP3A4

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
CN-114920871-A Optical-grade polymethyl methacrylate resin and application thereof 万华化学集团股份有限公司 2022-08-19 — — CN disclosed
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