SCHEMBL7609396

SCHEMBL7609396

CCCCCC(C(=O)O)c1cc(P(=O)(O)Cc2ccccc2)cc2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.40
ACP3 P15309 1/20 0.37
CNR2 P34972 1/20 0.37
CTSG P08311 1/20 0.37
TACR3 P29371 1/20 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
SCHEMBL7604389 0.97 TACR3 (0.39) CETPACP3CNR2CTSGTACR3
SCHEMBL7609378 0.92 ACP3 (0.39) CETPACP3CTSG
SCHEMBL7604547 0.88 ACP3 (0.40) ACP3CTSG
SCHEMBL7609846 0.83 CNR2 (0.41) CETPCNR2
SCHEMBL7610424 0.82 CTSG (0.43) ACP3CTSG
SCHEMBL7607401 0.80 CNR2 (0.40) CETPCNR2
SCHEMBL5156697 0.76 KDM4E (0.47) CNR2
SCHEMBL8015861 0.75 KDM4E (0.49) CNR2TACR3
SCHEMBL2024342 0.75 KDM4E (0.49) CNR2TACR3
SCHEMBL1826965 0.75 KDM4E (0.49) CNR2TACR3

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

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