SCHEMBL8636616

SCHEMBL8636616

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

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALDH1A1 P00352 8/20 0.48
CFTR P13569 1/20 0.46
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
RAB9A P51151 1/20 0.43
KMT2A Q03164 2/20 0.42
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
PTPN1 P18031 1/20 0.40
CYP2A6 P11509 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
SCHEMBL8636618 0.94 CYP2C9 (0.54) CYP2C9CYP2C19ALDH1A1CFTRKDM4E
SCHEMBL8758097 0.85 CYP2C9 (0.68) CYP2C9CYP2C19ALDH1A1CFTRKMT2A
SCHEMBL13858834 0.80 PTPN1 (0.59) CYP2C9CYP2C19ALDH1A1KDM4ESMN1; SMN2
SCHEMBL8757958 0.76 CYP2C9 (0.47) CYP2C9CYP2C19CFTRSMN1; SMN2CYP2A6
SCHEMBL28948550 0.75 TDP1 (0.68) ALDH1A1KDM4ESMN1; SMN2KMT2ALMNA
SCHEMBL8634980 0.75 CYP2C9 (0.46) CYP2C9CYP2C19ALDH1A1CFTRSMN1; SMN2
SCHEMBL8636320 0.74 ALDH1A1 (0.49) CYP2C9CYP2C19ALDH1A1KDM4ESMN1; SMN2
SCHEMBL8732233 0.73 ADRB3 (0.48) CYP2C9CYP2C19ALDH1A1CYP2A6
SCHEMBL8758035 0.73 ADRB3 (0.48) CYP2C9CYP2C19ALDH1A1CYP2A6
SCHEMBL16350513 0.72 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2RAB9AKMT2A

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