SCHEMBL11248290

SCHEMBL11248290

O=P(O)(O)OCC(CO)(CO)CCCl

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 19/20 0.35
S1PR3 Q99500 17/20 0.35
S1PR4 O95977 3/20 0.33
S1PR5 Q9H228 3/20 0.33
S1PR2 O95136 2/20 0.33
FBP1 P09467 1/20 0.31

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
SCHEMBL11155433 0.96 S1PR1 (0.35) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL29052002 0.90 FBP1 (0.33) S1PR1S1PR3FBP1
SCHEMBL11230791 0.84
SCHEMBL11154911 0.83 S1PR1 (0.33) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL9744029 0.83 S1PR1 (0.33) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL23777275 0.83 FBP1 (0.37) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL135753 0.83 FBP1 (0.37) S1PR1S1PR3S1PR4S1PR5S1PR2
SCHEMBL133396 0.83 FBP1 (0.37) S1PR1S1PR3S1PR4S1PR5S1PR2
Ethyl Chloride SCHEMBL11767133 0.82 S1PR1 (0.39) S1PR1S1PR3S1PR4S1PR5S1PR2
Ammonia Solution, Strong SCHEMBL5467104 0.81 S1PR1 (0.36) S1PR1S1PR3S1PR4S1PR5S1PR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4339357-A Intumescent composition GREAT LAKES CHEMICAL CORPORATION (US) 1982-07-13 US disclosed
US-4265791-A Novel phosphoric acid VELSICOL CHEMICAL CORPORATION (US) 1981-05-05 US disclosed
US-4205022-A 2,2-Bis(haloalkyl)-3-hydroxy-1-propyl phosphoric acids VELSICOL CHEMICAL CORPORATION (US) 1980-05-27 US disclosed