SCHEMBL6569223

SCHEMBL6569223

CCCCCCCCCCC(=O)NOP(=O)(O)OCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.50
CETP P11597 4/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HPGD P15428 1/20 0.46
LPAR1 Q92633 2/20 0.45
LPAR3 Q9UBY5 2/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL6569386 1.00 EPHX2 (0.50) EPHX2CETPMEN1KMT2AHPGD
SCHEMBL6570358 1.00 EPHX2 (0.50) EPHX2CETPMEN1KMT2AHPGD
SCHEMBL6569347 1.00 EPHX2 (0.50) EPHX2CETPMEN1KMT2AHPGD
SCHEMBL6569306 1.00 EPHX2 (0.50) EPHX2CETPMEN1KMT2AHPGD
SCHEMBL6568704 0.99 EPHX2 (0.48) EPHX2CETPMEN1KMT2AHPGD
SCHEMBL6570330 0.95 TDP1 (0.46) EPHX2CETPMEN1KMT2AHPGD
SCHEMBL6570142 0.91 KDM4E (0.50) MEN1KMT2AHPGD
SCHEMBL6569921 0.90 HDAC1 (0.51) LPAR1
SCHEMBL6571631 0.90 GAA (0.43) CETPHPGD
SCHEMBL6569952 0.88 SMN1; SMN2 (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 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