SCHEMBL15545754

SCHEMBL15545754

CC(C)COP(O)(O)=S.[NaH]

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 16/20 0.40
LPAR2 Q9HBW0 12/20 0.40
LPAR1 Q92633 11/20 0.40
LPAR6 P43657 6/20 0.40
LPAR4 Q99677 6/20 0.40
LPAR5 Q9H1C0 6/20 0.40
ENPP2 Q13822 6/20 0.35

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
SCHEMBL8655658 0.97
SCHEMBL27791034 0.95 LPAR3 (0.40) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL5337069 0.81 ALDH1A1 (0.31) LPAR3LPAR2
SCHEMBL10017365 0.81 LPAR3 (0.41) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL3822463 0.79
Ammonia Solution, Strong SCHEMBL29183576 0.79 CYP3A4 (0.30)
SCHEMBL3924420 0.79
SCHEMBL8089267 0.79 CYP3A4 (0.30)
SCHEMBL28462017 0.78 LPAR2 (0.30) LPAR3LPAR2LPAR1LPAR6LPAR4
SCHEMBL11480345 0.77

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-20150209801-A1 MONOTHIOPHOSPHATE CONTAINING COLLECTORS AND METHODS TEEBEE HOLDINGS PTY LTD (AU) 2015-07-30 US disclosed
WO-2014012139-A1 MONOTHIOPHOSPHATE CONTAINING COLLECTORS AND METHODS TEEBEE HOLDINGS PTY LTD (AU) 2014-01-23 WO disclosed