SCHEMBL1728537

SCHEMBL1728537

O=C(O)NCc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.68
HPGD P15428 3/20 0.65
HTT P42858 2/20 0.59
LMNA P02545 1/20 0.59
CYP3A4 P08684 1/20 0.59
MMP13 P45452 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CYP1A2 P05177 1/20 0.58
CYP2D6 P10635 1/20 0.58
CYP2C9 P11712 1/20 0.58
TSHR P16473 1/20 0.58
CYP2C19 P33261 1/20 0.58
FFAR1 O14842 2/20 0.56
HRH3 Q9Y5N1 2/20 0.56
KMT2A Q03164 2/20 0.55
GAA P10253 2/20 0.55
MEN1 O00255 1/20 0.55
POLB P06746 1/20 0.55
FFAR4 Q5NUL3 1/20 0.55
LTA4H P09960 1/20 0.55

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
SCHEMBL6257688 0.91 MAPK14 (0.84) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL2851912 0.86 MAPK14 (0.64) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL27593863 0.86 HPGD (0.61) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL1680843 0.84 NPC1 (0.71) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL5709300 0.84 HPGD (0.84) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL13192876 0.83 HPGD (0.62) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL13192880 0.83 RNF4 (0.62) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL10133183 0.83 NPC1 (0.75) MAPK14HPGDLMNATSHRKMT2A
SCHEMBL14944099 0.83 MAPK14 (0.61) MAPK14HPGDHTTLMNACYP3A4
SCHEMBL6178139 0.82 CYP1A2 (0.51) MAPK14HPGDHTTLMNACYP3A4

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
EP-1673337-B1 Arylalkylcarbamate derivatives, preparation method thereof and use of same in therapeutics SANOFI SA (FR) 2011-11-23 EP disclosed
EP-1972616-A1 Derivatives of arylalkylcarbamates, process for their preparation and therapeutic application thereof Sanofi-Aventis (FR) 2008-09-24 EP disclosed
EP-1673337-A2 ARYLALKYLCARBAMATE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2006-06-28 EP disclosed
WO-2005033066-A2 ARYLALKYLCARBAMATE DERIVATIVES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2005-04-14 WO disclosed