SCHEMBL7609846

SCHEMBL7609846

CCCCCC(C(=O)O)c1cc2ccccc2cc1P(=O)(O)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.41
CETP P11597 6/20 0.41
PPARG P37231 6/20 0.38
PPARA Q07869 4/20 0.38
PTGES O14684 2/20 0.36
ALOX5 P09917 2/20 0.36

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
SCHEMBL7607401 0.96 CNR2 (0.40) CNR2CETPPPARGPPARAPTGES
SCHEMBL7610445 0.92 PPARG (0.41) CNR2CETPPPARGPPARA
SCHEMBL7610507 0.88 AKR1C3 (0.39) CETPPPARGPPARA
SCHEMBL7609396 0.83 CETP (0.40) CNR2CETP
SCHEMBL8460361 0.80 MEN1 (0.38) PPARGPPARA
SCHEMBL7604389 0.80 TACR3 (0.39) CNR2CETPPTGESALOX5
SCHEMBL20678488 0.77 PPARG (0.45) CNR2CETPPPARGPPARAPTGES
SCHEMBL7609378 0.74 ACP3 (0.39) CETPPPARGPPARA
SCHEMBL7611820 0.74 MMP1 (0.35) CETP
SCHEMBL7608846 0.71 CYSLTR2 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002515040-A 2002-05-21 JP claimed
JP-2002514160-A 2002-05-14 JP claimed
EP-0954295-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-11-10 EP claimed
EP-0936914-A1 HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-08-25 EP claimed
EP-0936914-A4 1999-08-25 EP claimed
WO-1997048400-A1 HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-12-24 WO claimed
WO-1997048409-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-12-24 WO claimed
EP-0954295-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-11-10 EP disclosed
WO-1997048409-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-12-24 WO disclosed