SCHEMBL8634980

SCHEMBL8634980

CC(=O)Cc1ccc(OCP(=O)(O)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
POLB P06746 1/20 0.45
ALOX5 P09917 3/20 0.43
CFTR P13569 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
ADRB3 P13945 1/20 0.41
MAOB P27338 1/20 0.40
PTPN1 P18031 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL8634990 0.94 CYP2C9 (0.50) CYP2C9CYP2C19POLBALOX5CFTR
SCHEMBL9063248 0.82 PTPN1 (0.58) CYP2C9CYP2C19POLBALOX5SMN1; SMN2
SCHEMBL8758097 0.81 CYP2C9 (0.68) CYP2C9CYP2C19POLBCFTRL3MBTL1
SCHEMBL8757958 0.78 CYP2C9 (0.47) CYP2C9CYP2C19CFTRSMN1; SMN2MAOB
SCHEMBL8732233 0.78 ADRB3 (0.48) CYP2C9CYP2C19ADRB3ALDH1A1
SCHEMBL8758035 0.78 ADRB3 (0.48) CYP2C9CYP2C19ADRB3ALDH1A1
SCHEMBL10861821 0.77 PKM (0.58) POLBALOX5SMN1; SMN2RAB9AL3MBTL1
SCHEMBL8758970 0.75 POLB (0.46) CYP2C9CYP2C19POLBALOX5SMN1; SMN2
SCHEMBL68570 0.75 ALOX5 (0.69) CYP2C19ALOX5SMN1; SMN2NPC1RAB9A
SCHEMBL8636616 0.75 CYP2C9 (0.50) CYP2C9CYP2C19CFTRSMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0717746-B1 PHOSPHINIC ACID DERIVATIVES WITH ANTI-HYPER GLYCEMIC AND/OR ANTI-OBESITY ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1998-07-15 EP disclosed
EP-0717746-A1 PHOSPHINIC ACID DERIVATIVES WITH ANTI-HYPER GLYCEMIC AND/OR ANTI-OBESITY ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1996-06-26 EP disclosed
WO-1995007284-A1 PHOSPHINIC ACID DERIVATIVES WITH ANTI-HYPER GLYCEMIC AND/OR ANTI-OBESITY ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1995-03-16 WO disclosed