SCHEMBL7920074

SCHEMBL7920074

CCCCCCC(C(C)(C(=O)O)c1cc2ccccc2[nH]1)P(=O)(O)Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.39
DRD3 P35462 1/20 0.39
CCKBR P32239 1/20 0.38
CETP P11597 4/20 0.37
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
IDO1 P14902 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35

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
SCHEMBL7928376 0.77 CETP (0.39) CETPPPARGPPARA
SCHEMBL7928430 0.75 CETP (0.36) CETPPPARGPPARAMMP2MMP3
SCHEMBL7926749 0.74 PTPN1 (0.43) CETPPPARGPPARA
SCHEMBL8060087 0.74 IDO1 (0.40) DRD2DRD3GAAHPGDIDO1
SCHEMBL5060429 0.74 ADAMTS4 (0.38) DRD2DRD3CCKBRCETP
SCHEMBL7931915 0.72 CETP (0.41) CETPPPARGPPARA
SCHEMBL7610568 0.72 IDO1 (0.42) GAAHPGDIDO1
SCHEMBL7605830 0.71 IDO1 (0.41) DRD2DRD3GAAHPGDIDO1
SCHEMBL7607603 0.70 IDO1 (0.40) GAAHPGDIDO1
SCHEMBL7925674 0.69 KDM4E (0.38) CETP

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