SCHEMBL22325599

SCHEMBL22325599

CCCCCCCCCOP(=O)(O)O.CCCCCCCCCOP(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 14/20 1.00
LPAR2 Q9HBW0 10/20 1.00
LPAR1 Q92633 7/20 1.00
LPAR5 Q9H1C0 1/20 0.59
CYP3A4 P08684 1/20 0.52
SMPD1 P17405 1/20 0.50

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
SCHEMBL7942221 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL8033780 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL29136 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
Hexadecyl Dihydrogen Phosphate SCHEMBL63748 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL118839 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
Phosphoric Acid Monododecyl Ester SCHEMBL9437045 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL1923668 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
Phosphoric Acid Monododecyl Ester SCHEMBL9316956 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
Phosphoric Acid Monododecyl Ester SCHEMBL11052336 1.00 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5CYP3A4
SCHEMBL9815356 1.00 LPAR3 (1.00) 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
WO-2020162303-A1 HYDROPHOBIC ALGINIC ACID PARTICLE GROUP AND METHOD FOR PRODUCING SAME 日清紡ホールディングス株式会社 2020-08-13 WO disclosed