SCHEMBL8103307

SCHEMBL8103307

CC(=O)OC[C@H](CO)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
PRKCA P17252 2/20 0.50
PRKCD Q05655 2/20 0.50
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 1/20 0.43
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
CYP3A4 P08684 1/20 0.41
GABBR2 O75899 1/20 0.41
GABBR1 Q9UBS5 1/20 0.41
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
GLS O94925 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
SCHEMBL2705027 1.00 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL2705028 1.00 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
Carbamic Acid SCHEMBL8392185 0.95 CYP1A2 (0.60) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
Carbamic Acid SCHEMBL8392184 0.95 CYP1A2 (0.60) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
Carbamic Acid SCHEMBL8934351 0.95 CYP1A2 (0.60) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL8089832 0.92 CYP1A2 (0.57) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL8089829 0.92 CYP1A2 (0.57) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL9771995 0.91 CYP1A2 (0.67) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL7019140 0.86 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL3008828 0.86 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0802901-B1 NOVEL CARBAMATE COMPOUNDS CONTAINING THIOCARBAMOYL GROUP AND PROCESS FOR PREPARING THE SAME YUKONG LTD (KR) 2000-10-04 EP claimed
CN-1077570-C Novel sulfamate compound containing N-substituted carbamoyl group and preparation thereof SK LTD (KR) 2002-01-09 CN disclosed
EP-0801642-B1 NOVEL SULFAMATE COMPOUND CONTAINING N-SUBSTITUTED CARBAMOYL GROUP AND METHOD FOR PREPARING THE SAME YUKONG LTD (KR) 2000-12-20 EP disclosed
US-5892088-A Sulfamate compound containing N-substituted carbamoyl group and method for preparing the same YUKONG LIMITED (KR) 1999-04-06 US disclosed
CN-1173864-A Novel sulfamate compound containing N-substituted carbamoyl group and preparation thereof YUKONG LTD (KR) 1998-02-18 CN disclosed
EP-0801642-A1 NOVEL SULFAMATE COMPOUND CONTAINING N-SUBSTITUTED CARBAMOYL GROUP AND METHOD FOR PREPARING THE SAME YUKONG LIMITED (KR) 1997-10-22 EP disclosed
WO-1997016418-A1 NOVEL SULFAMATE COMPOUND CONTAINING N-SUBSTITUTED CARBAMOYL GROUP AND METHOD FOR PREPARING THE SAME YUKONG LIMITED (KR) 1997-05-09 WO disclosed
EP-0730576-A1 NOVEL CARBAMATE COMPOUNDS AND PROCESSES FOR PREPARING THE SAME YUKONG LIMITED (KR) 1996-09-11 EP disclosed
WO-1996009284-A1 NOVEL CARBAMATE COMPOUNDS AND PROCESSES FOR PREPARING THE SAME YUKONG LIMITED (KR) 1996-03-28 WO disclosed