SCHEMBL6928775

SCHEMBL6928775

C=C(C)C(=O)Oc1c(O)cccc1C(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.56
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
LIG1 P18858 1/20 0.41
MAPT P10636 5/20 0.41
HPGD P15428 5/20 0.41
HSD17B10 Q99714 5/20 0.41
MAPK1 P28482 4/20 0.41
KDM4E B2RXH2 4/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
CYP1A2 P05177 1/20 0.41
PGR P06401 1/20 0.41
CYP2D6 P10635 1/20 0.41
SLC6A2 P23975 1/20 0.41
PDE4A P27815 1/20 0.41
CYP2C19 P33261 1/20 0.41
HRH1 P35367 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL10662113 0.87 ELANE (0.57) ELANEMAPTHPGDHSD17B10MAPK1
Benzoic Acid SCHEMBL10793762 0.84 ELANE (0.53) ELANEMAPTHSD17B10LMNAALDH1A1
SCHEMBL15495801 0.83 THRB (0.41) ELANEMAOAMAOBMAPTHPGD
SCHEMBL820869 0.81 ELANE (0.57) ELANEMAPTHPGDHSD17B10MAPK1
SCHEMBL10407840 0.81 ELANE (0.46) ELANEMAOAMAOBMAPTHPGD
SCHEMBL1415831 0.81 TDP1 (0.46) ELANEMAOAMAOBLIG1MAPT
SCHEMBL474811 0.80 ELANE (0.64) ELANEMAPTHPGDHSD17B10MAPK1
SCHEMBL29670258 0.80 ELANE (0.64) ELANEMAPTHPGDHSD17B10MAPK1
SCHEMBL5065272 0.80 ELANE (0.47) ELANEMAPTHPGDHSD17B10MAPK1
SCHEMBL15495958 0.79 LMNA (0.53) ELANEMAPTHPGDHSD17B10KDM4E

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-1216142-A4 THERMOFORMABLE OPHTHALMIC LENS NOVARTIS AG (CH) 2003-06-11 EP disclosed
EP-1216142-A1 THERMOFORMABLE OPHTHALMIC LENS Wesley Jessen Corporation (US) 2002-06-26 EP disclosed
WO-2001005578-A1 THERMOFORMABLE OPHTHALMIC LENS WESLEY-JESSEN CORPORATION (US) 2001-01-25 WO disclosed