SCHEMBL7900885

SCHEMBL7900885

CCCCCCCCCCCCOP(=O)(N(CCO)CCO)N(CCO)CCO

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.53
LPAR2 Q9HBW0 7/20 0.53
LPAR1 Q92633 6/20 0.53
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
CYP3A4 P08684 1/20 0.41
LMNA P02545 1/20 0.40
ESR1 P03372 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CDC25A P30304 1/20 0.40
AGTR1 P30556 1/20 0.40
AKT1 P31749 1/20 0.40
ADRA1A P35348 1/20 0.40
KCNH2 Q12809 1/20 0.40
LPAR5 Q9H1C0 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL7900868 0.86 LPAR3 (0.53) LPAR3LPAR2LPAR1MEN1THRB
SCHEMBL7889487 0.78 CYP3A4 (0.48) LPAR3LPAR2LPAR1CYP3A4TSHR
Trolamine SCHEMBL4951367 0.77 LPAR3 (0.56) LPAR3LPAR2LPAR1LPAR5
Hexadecyl Dihydrogen Phosphate SCHEMBL9302969 0.77 LPAR3 (0.72) LPAR3LPAR2LPAR1LPAR5
Trolamine SCHEMBL10437956 0.77 LPAR3 (0.72) LPAR3LPAR2LPAR1LPAR5
Trolamine SCHEMBL23698926 0.77 LPAR3 (0.56) LPAR3LPAR2LPAR1LPAR5
Phosphoric Acid Monododecyl Ester SCHEMBL3470168 0.77 LPAR3 (0.72) LPAR3LPAR2LPAR1LPAR5
Phosphoric Acid Monododecyl Ester SCHEMBL322337 0.77 LPAR3 (0.72) LPAR3LPAR2LPAR1LPAR5
Trolamine SCHEMBL11209409 0.77 LPAR3 (0.72) LPAR3LPAR2LPAR1LPAR5
Trolamine SCHEMBL9167368 0.77 LPAR3 (0.56) LPAR3LPAR2LPAR1LPAR5

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-6190574-B1 OIL ADDITIVE KAO CORPORATION (JP) 2001-02-20 US disclosed