SCHEMBL6569146

SCHEMBL6569146

CCCCCCC(C)(C)C(=O)NOP(=O)(O)OCCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.45
S1PR4 O95977 9/20 0.41
S1PR1 P21453 9/20 0.41
S1PR3 Q99500 9/20 0.41
S1PR5 Q9H228 9/20 0.41
S1PR2 O95136 2/20 0.39
GGPS1 O95749 1/20 0.39

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
SCHEMBL6570293 0.84 POLB (0.48) S1PR4S1PR1S1PR3S1PR5
SCHEMBL6569386 0.82 EPHX2 (0.50) CETP
SCHEMBL6570358 0.82 EPHX2 (0.50) CETP
SCHEMBL6569306 0.82 EPHX2 (0.50) CETP
SCHEMBL6569347 0.82 EPHX2 (0.50) CETP
SCHEMBL6569223 0.82 EPHX2 (0.50) CETP
SCHEMBL6568523 0.81 CETP (0.48) CETP
SCHEMBL6568704 0.81 EPHX2 (0.48) CETP
SCHEMBL6569503 0.80 HPGD (0.50) CETP
SCHEMBL6570330 0.79 TDP1 (0.46) CETP

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
EP-1156054-B1 DRUGS CONTAINING PHOSPHORIC ACID DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2004-04-14 EP claimed
US-6495533-B1 TUMOR NECROSIS FACTOR INHIBITORS; RHEUMATOID ARTHRITIS, ULCERATIVE COLITIS, CROHN'S DISEASE, HEPATITIS, SEPSIS, HEMORRHAGIC SHOCK, MULTIPLE SCLEROSIS, CEREBRAL INFARCTION, DIABETES, INTERSTITIAL PNEUMONIA, PAIN, HIV ONO PHARMACEUTICAL CO., LTD. (JP) 2002-12-17 US claimed
EP-1156054-A1 DRUGS CONTAINING PHOSPHORIC ACID DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-11-21 EP claimed