SCHEMBL373312

SCHEMBL373312

C=CC(=O)OC(c1ccccc1)N(C)C

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
HCAR2 Q8TDS4 1/20 0.41
THRB P10828 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 2/20 0.37
KMT2A Q03164 1/20 0.37
AKT1 P31749 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.35
CYP2D6 P10635 1/20 0.34
SRC P12931 1/20 0.34
ALOX5 P09917 1/20 0.34
MTOR P42345 1/20 0.34

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
Bromide SCHEMBL28615277 0.98 LMNA (0.47) LMNAHCAR2THRBCHRNB2CHRNB4
Fluoride SCHEMBL28988172 0.81 HCAR2 (0.44) LMNAHCAR2THRBCYP2C19ALDH1A1
SCHEMBL5664548 0.81 HCAR2 (0.43) LMNAHCAR2THRBCHRNB2CHRNB4
Fluoride SCHEMBL28527584 0.80 HCAR2 (0.42) LMNAHCAR2THRBCHRNB2CHRNB4
Iodide SCHEMBL22042239 0.80 HCAR2 (0.42) LMNAHCAR2THRBCHRNB2CHRNB4
Hydrochloric Acid SCHEMBL5000725 0.80 HCAR2 (0.42) LMNAHCAR2THRBCHRNB2CHRNB4
SCHEMBL5580239 0.80 KDM4E (0.45) LMNAHCAR2THRBCHRNB2CHRNB4
Bromide SCHEMBL28534138 0.80 HCAR2 (0.42) LMNAHCAR2THRBCHRNB2CHRNB4
Hydrochloric Acid SCHEMBL7722976 0.78 ALDH1A1 (0.44) LMNAHCAR2THRBCHRNB2CHRNB4
SCHEMBL961211 0.77 THRB (0.41) LMNAHCAR2THRBCYP2C19KMT2A

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 93 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6576255-B1 Injection molding method for (meth)acrylate copolymers having tertiary ammonium groups ROEHM GMBH & CO. KG (DE) 2003-06-10 US claimed
US-20220287345-A1 SOLUBILITY ENHANCEMENT OF POORLY SOLUBLE ACTIVES EVONIK OPERATIONS GMBH (DE) 2022-09-15 US disclosed
EP-2568967-B2 PHARMACEUTICAL COMPOSITIONS COMPRISING HYDROMORPHONE AND NALOXONE EURO CELTIQUE SA (LU) 2022-07-27 EP disclosed
EP-4009961-A1 SOLUBILITY ENHANCEMENT OF POORLY SOLUBLE ACTIVES Evonik Operations GmbH (DE) 2022-06-15 EP disclosed
WO-2021023857-A1 SOLUBILITY ENHANCEMENT OF POORLY SOLUBLE ACTIVES EVONIK OPERATIONS GMBH (DE) 2021-02-11 WO disclosed
US-20190224130-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING HYDROMORPHONE AND NALOXONE PURDUE PHARMA (CA) 2019-07-25 US disclosed
EP-3505162-A1 USE OF BINDERS FOR MANUFACTURING STORAGE STABLE FORMULATIONS Euro-Celtique S.A. (LU) 2019-07-03 EP disclosed
US-10113050-B2 Powdery or granulated composition comprising a copolymer, a dicarboxylic acid and a fatty monocarboxylic acid EVONIK ROEHM GMBH (DE) 2018-10-30 US disclosed
EP-2568967-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING HYDROMORPHONE AND NALOXONE EURO CELTIQUE SA (LU) 2018-10-24 EP disclosed
EP-2603205-B1 USE OF BINDERS FOR MANUFACTURING STORAGE STABLE FORMULATIONS EURO CELTIQUE SA (LU) 2018-10-03 EP disclosed
US-20050142174-A1 Adhesive and binding agent for dermal or transdermal treatment systems ROEHM GMBH & CO. KG 2005-06-30 US disclosed
US-20050019381-A1 Binding agent which is stable in storage and used for pharmaceutical applications ROEHM GMBH & CO. KG (DE) 2005-01-27 US disclosed
US-6846891-B2 Coating and binding agent for oral or dermal pharmaceutical forms ROEHM GMBH & CO. KG (DE) 2005-01-25 US disclosed
US-20040249035-A1 Granulate or powder for producing coating or binding agents for medicaments PETEREIT HANS-ULRICH (DE) 2004-12-09 US disclosed
US-20040247687-A1 Method for production of active ingredient-containing pellets ROEHM GMBH & CO. KG (DE) 2004-12-09 US disclosed
US-20030220413-A1 Coating and binding agent for oral or dermal pharmaceutical forms ROEHM GMBH & CO. KG (DE) 2003-11-27 US disclosed
US-6624210-B1 (Meth)acrylate ester copolymer with (meth)acrylate containing tertiary amine group, plasticizer, and emulsifier; powders, pastes, aqueous suspension; encapsulation; drug delivery ROEHM GMBH & CO. KG (DE) 2003-09-23 US disclosed
US-6576255-B1 Injection molding method for (meth)acrylate copolymers having tertiary ammonium groups ROEHM GMBH & CO. KG (DE) 2003-06-10 US disclosed
US-20030064036-A1 Coating and binding agent for pharmaceutical formulations with improved storage stability ROEHM GMBH (DE) 2003-04-03 US disclosed
US-4705695-A AMMONIUM SALT OF TERTIARY AMINE SUBSTITUTED ACRYLIC POLYMER ROHM GMBH CHEMISCHE FABRIK (DE) 1987-11-10 US disclosed