SCHEMBL6569272

SCHEMBL6569272

CCCCCCCC(=O)NOP(=O)(O)OCCc1cccc(OC(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
PPARG P37231 2/20 0.45
PPARA Q07869 2/20 0.45
P2RY10 O00398 1/20 0.45
EPHX2 P34913 2/20 0.44
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
GGPS1 O95749 1/20 0.42
GPR174 Q9BXC1 1/20 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
SCHEMBL6571850 0.88 EPHX2 (0.58) CNR1CNR2P2RY10EPHX2HDAC1
SCHEMBL6569856 0.88 CNR1 (0.58) CNR1CNR2P2RY10GGPS1GPR174
SCHEMBL6571745 0.87 EPHX1 (0.44) CNR1CNR2P2RY10HDAC3HDAC1
SCHEMBL6571796 0.87 CNR1 (0.55) CNR1CNR2P2RY10GGPS1GPR174
SCHEMBL6570365 0.87 EPHX2 (0.56) CNR1CNR2EPHX2HDAC1
SCHEMBL6569880 0.85 P2RY10 (0.51) CNR1CNR2P2RY10HDAC3HDAC1
SCHEMBL6569386 0.83 EPHX2 (0.50) EPHX2
SCHEMBL6569347 0.83 EPHX2 (0.50) EPHX2
SCHEMBL6569223 0.83 EPHX2 (0.50) EPHX2
SCHEMBL6569306 0.83 EPHX2 (0.50) EPHX2

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