SCHEMBL8364493

SCHEMBL8364493

CCCCCCCCc1ccc(OCC(O)COC(F)(F)C(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 4/20 0.56
▸ S1PR4 O95977 3/20 0.46
▸ S1PR5 Q9H228 3/20 0.46
▸ S1PR2 O95136 2/20 0.46
▸ S1PR3 Q99500 2/20 0.46
▸ PLA2G4B P0C869 1/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CASP1 P29466 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ SLCO1B3 Q9NPD5 1/20 0.45
▸ SLCO1B1 Q9Y6L6 1/20 0.45
▸ ADRB2 P07550 3/20 0.42
▸ FAAH O00519 1/20 0.42
▸ PLA2G4A P47712 1/20 0.41

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
SCHEMBL14900555 0.81 S1PR1 (0.65) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL4071970 0.81 LMNA (0.44) PLA2G4BLMNAMAPK1KDM4EHIF1A
SCHEMBL10805745 0.80 S1PR1 (0.55) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL11359034 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL11355760 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL11362458 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL6226494 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL10803483 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL1150684 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3
SCHEMBL11367486 0.79 S1PR1 (0.66) S1PR1S1PR4S1PR5S1PR2S1PR3

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-1999012878-A1 SOLVENT AND PROCESS FOR EXTRACTING CESIUM FROM ALKALINE WASTE SOLUTIONS LOCKHEED MARTIN ENERGY RES COR (US) 1999-03-18 — — WO claimed
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