SCHEMBL6568523

SCHEMBL6568523

CCCCCCOC(=O)NOP(=O)(O)OCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.48
CTSK P43235 2/20 0.46
P2RY10 O00398 5/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.44
GPR34 Q9UPC5 1/20 0.43
GAA P10253 1/20 0.43
RECQL P46063 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL6568562 0.87 HDAC3 (0.44) CTSKNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL6571685 0.86 CTSK (0.44) CETPCTSKNPC1RAB9ASMN1; SMN2
SCHEMBL6570358 0.85 EPHX2 (0.50) CETP
SCHEMBL6569386 0.85 EPHX2 (0.50) CETP
SCHEMBL6569347 0.85 EPHX2 (0.50) CETP
SCHEMBL6569223 0.85 EPHX2 (0.50) CETP
SCHEMBL6569306 0.85 EPHX2 (0.50) CETP
SCHEMBL6568704 0.83 EPHX2 (0.48) CETP
SCHEMBL6569503 0.83 HPGD (0.50) CETPNPC1RAB9ALMNA
SCHEMBL6569366 0.83 CETP (0.44) CETPP2RY10NPC1RAB9AGPR34

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