SCHEMBL7928376

SCHEMBL7928376

CCCCCCC(C(C)(C(=O)O)c1ccccn1)P(=O)(O)Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.39
CNR2 P34972 1/20 0.36
ALOX12 P18054 1/20 0.35
PRSS1 P07477 2/20 0.35
CTSG P08311 2/20 0.35
CTRB1 P17538 2/20 0.35
CMA1 P23946 2/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
LPAR3 Q9UBY5 1/20 0.35
CTRC Q99895 1/20 0.34
ENPP2 Q13822 2/20 0.34
CSNK1E P49674 1/20 0.34
DGAT2 Q96PD7 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL7926683 0.79 CETP (0.37) CETP
SCHEMBL29010721 0.77 LMNA (0.39) CNR2ALOX12PRSS1CTSGCTRB1
SCHEMBL7928430 0.77 CETP (0.36) CETPCNR2PRSS1CTSGCTRB1
SCHEMBL7920074 0.77 DRD2 (0.39) CETPPPARGPPARA
SCHEMBL5053127 0.71 CETP (0.38) CETPCNR2ALOX12PPARGCYP1A2
SCHEMBL5053338 0.71 LPAR3 (0.42) CETPCNR2ALOX12PPARGLPAR3
SCHEMBL7926749 0.70 PTPN1 (0.43) CETPPPARGPPARA
SCHEMBL7929167 0.69 CETP (0.37) CETPCNR2PRSS1CTSGCTRB1
SCHEMBL7607667 0.69 LMNA (0.40) CETP
SCHEMBL7931915 0.69 CETP (0.41) CETPCNR2PRSS1CTSGCTRB1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994707-A4 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2001-11-14 EP claimed
EP-0994707-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 2000-04-26 EP claimed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO claimed
EP-0994707-A4 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2001-11-14 EP disclosed
EP-0994707-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 2000-04-26 EP disclosed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO disclosed