SCHEMBL8046811

SCHEMBL8046811

O=C(O)C(OP(=O)(O)Cc1ccccc1F)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ATM Q13315 1/20 0.38
CXCL8 P10145 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
POLB P06746 1/20 0.35
SRC P12931 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
SCHEMBL8064071 0.84 AKR1B1 (0.41) PPARGPPARAALDH1A1SRC
SCHEMBL5051096 0.81 ACP3 (0.54) ALDH1A1
SCHEMBL5054709 0.81 ACP3 (0.44) SRC
SCHEMBL8061504 0.81 KLK7 (0.41) PPARGPPARAALDH1A1MEN1KMT2A
SCHEMBL5060095 0.77 FOLH1 (0.41) PPARGPPARAALDH1A1MEN1KMT2A
SCHEMBL5054362 0.76 HPGDS (0.38) GAAMEN1KMT2APOLB
SCHEMBL5052757 0.76 PPARA (0.43) PPARGPPARAALDH1A1POLBSRC
SCHEMBL5054488 0.76 SMN1; SMN2 (0.50) ALDH1A1GAAMEN1KMT2AFNTA
SCHEMBL8058398 0.75 PKM (0.48) PPARGPPARAMEN1KMT2A
SCHEMBL5051263 0.75 LMNA (0.41) GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6046180-A NAALADase inhibitors GUILFORD PHARMACEUTICALS INC. (US) 2000-04-04 US 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