SCHEMBL8733228

SCHEMBL8733228

CCCCCCCCCCS(=O)(=O)NC(CCCCCC)COP(=O)(O)CCCCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.52
S1PR1 P21453 11/20 0.42
S1PR3 Q99500 9/20 0.42
S1PR4 O95977 8/20 0.42
S1PR5 Q9H228 7/20 0.42
S1PR2 O95136 2/20 0.42

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
SCHEMBL8972694 0.87 CETP (0.50) CETP
SCHEMBL8973335 0.87 CETP (0.50) CETP
SCHEMBL8972562 0.87 CETP (0.50) CETP
SCHEMBL8730243 0.85 PLA2G2A (0.47) CETP
SCHEMBL8733002 0.84 CETP (0.40) CETPS1PR1S1PR3S1PR4S1PR5
SCHEMBL8729241 0.84 CETP (0.40) CETPS1PR1S1PR3S1PR4S1PR5
SCHEMBL8732993 0.84 CETP (0.40) CETPS1PR1S1PR3S1PR4S1PR5
SCHEMBL8973086 0.83 TLR2 (0.40) CETPS1PR1S1PR3S1PR4S1PR5
SCHEMBL8728138 0.81 CETP (0.41) CETPS1PR1S1PR3S1PR4S1PR5
SCHEMBL8972402 0.81 PLA2G2A (0.43)

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
EP-0701561-B1 DESOXYAZAPHOSPHOLIPID DERIVATIVES HAVING INHIBITING ACTIVITY ON PHOSPHOLIPASE A2 MENARINI LAB (ES) 1998-08-19 EP claimed