SCHEMBL4953155

SCHEMBL4953155

C=CCN(C(=O)ON)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
POLB P06746 1/20 0.41
KDM4E B2RXH2 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 3/20 0.41
GLA P06280 1/20 0.41
ESR1 P03372 1/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ADRA2C P18825 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL5805479 0.83 TSHR (0.57) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL327647 0.81 TSHR (0.50) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL9711947 0.81 TSHR (0.51) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL10619595 0.80 ALDH1A1 (0.57) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL946547 0.80 TSHR (0.53) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL9249496 0.80 TSHR (0.53) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL3081849 0.80 HCAR2 (0.47) TSHRKMT2AMEN1ALDH1A1ESR1
SCHEMBL9329275 0.80 TSHR (0.53) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL5932535 0.79 TSHR (0.51) TSHRKMT2AMEN1POLBKDM4E
SCHEMBL28021915 0.78 TSHR (0.49) TSHRKMT2AMEN1POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856036-B1 AN EFFICIENT METHOD FOR PREPARATION OF (S)-3-[(1-DIMETHYL AMINO)ETHYL]-PHENYL-N-ETHYL-N-METHYL-CARBAMATE EMCURE PHARMACEUTICALS LTD (IN) 2016-12-14 EP disclosed
EP-1991524-A1 A PROCESS FOR THE PREPARATION OF PHENYLCARBAMATES Apotex Pharmachem Inc. (CA) 2008-11-19 EP disclosed
EP-1856036-A1 AN EFFICIENT METHOD FOR PREPARATION OF (S)-3-[(1-DIMETHYL AMINO)ETHYL]-PHENYL-N-ETHYL-N-METHYL-CARBAMATE Emcure Pharmaceuticals Limited (IN) 2007-11-21 EP disclosed
WO-2007098573-A1 A PROCESS FOR THE PREPARATION OF PHENYLCARBAMATES APOTEX PHARMACHEM INC. (CA) 2007-09-07 WO disclosed
WO-2006048720-A1 AN EFFICIENT METHOD FOR PREPARATION OF (S)-3-[(1-DIMETHYL AMINO)ETHYL]-PHENYL-N-ETHYL-N-METHYL-CARBAMATE EMCURE PHARMACEUTICALS LIMITED (IN) 2006-05-11 WO disclosed
WO-2005058804-A1 PROCESS FOR THE PREPARATION OF TERTIARY AMINES ATTACHED TO A SECONDARY CARBON CENTRE AVECIA PHARMACEUTICALS LIMITED (GB) 2005-06-30 WO disclosed