SCHEMBL7608720

SCHEMBL7608720

[CH2]C(CC)(OP(=O)(O)Cc1ccccc1)c1cccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 6/20 0.41
PTPRC P08575 1/20 0.35
PTK2B Q14289 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
CETP P11597 3/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL8048511 0.86 ACP3 (0.42) ACP3PTPRCPTK2BL3MBTL1KDM4E
SCHEMBL7611154 0.83 ACP3 (0.42) ACP3PTPRCL3MBTL1KDM4ELMNA
SCHEMBL7613491 0.80 ACP3 (0.44) ACP3PTPRCKDM4EPPARGPPARA
SCHEMBL8046802 0.79 ACP3 (0.39) ACP3HPGDCETPPPARGPPARA
SCHEMBL5053316 0.79 ACP3 (0.39) ACP3L3MBTL1KDM4ELMNAHPGD
SCHEMBL7611836 0.79 PTPN1 (0.46) CETPPPARGPPARA
SCHEMBL7605240 0.79 ACP3 (0.41) ACP3PTPRCKDM4ELMNAHPGD
SCHEMBL7608436 0.77 CETP (0.40) ACP3CETP
SCHEMBL7610662 0.77 ACP3 (0.40) ACP3PTPRCPTK2BL3MBTL1KDM4E
SCHEMBL8061548 0.76 ACP3 (0.41) ACP3PTPRCKDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002514184-A 2002-05-14 JP claimed
EP-1005348-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 2000-06-07 EP claimed
WO-1998013046-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO claimed
EP-1044206-A1 PRODRUGS OF NAALADASE INHIBITORS Guildford Pharmaceuticals Inc. (US) 2000-10-18 EP disclosed
EP-0949922-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATING COMPULSIVE DISORDERS USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-10-20 EP disclosed
WO-1999033849-A1 PRODRUGS OF NAALADASE INHIBITORS GUILDFORD PHARMACEUTICALS INC. (US) 1999-07-08 WO disclosed
WO-1998013044-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATING COMPULSIVE DISORDERS USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO disclosed