Urethane

Urethane

SCHEMBL6236113

CCCCC(CC)CO.CCOC(N)=O

nearest known ligand 0.62

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
ALOX15 P16050 1/20 0.52
CYP3A4 P08684 6/20 0.47
TSHR P16473 4/20 0.47
TDP1 Q9NUW8 2/20 0.47
ATM Q13315 1/20 0.47
CA2 P00918 5/20 0.43
CA1 P00915 2/20 0.43
LMNA P02545 3/20 0.42
RECQL P46063 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 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
Urethane SCHEMBL4258558 0.86 ALDH1A1 (0.62) ALDH1A1ALOX15CYP3A4TSHRTDP1
SCHEMBL467542 0.80 CYP3A4 (0.66) ALDH1A1CYP3A4TSHRTDP1ATM
Bicarbonate SCHEMBL28416513 0.79 ALDH1A1 (0.82) ALDH1A1CYP3A4TSHRTDP1ATM
Oxygen SCHEMBL21625615 0.79 ALDH1A1 (0.90) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL6249719 0.79 ALDH1A1 (1.00) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL9492501 0.79
SCHEMBL8420801 0.79
SCHEMBL16324 0.79
Ammonia Solution, Strong SCHEMBL23878442 0.79 CYP3A4 (0.64) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL23878448 0.79 CYP3A4 (0.64) ALDH1A1CYP3A4TSHRTDP1ATM

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-1192226-B1 ELECTRODEPOSITION BATH WITH WATER-SOLUBLE POLYVINYL ALCOHOL (CO)POLYMERS BASF COATINGS AG (DE) 2005-06-15 EP disclosed
EP-1192226-A1 ELECTRODEPOSITION BATH WITH WATER-SOLUBLE POLYVINYL ALCOHOL (CO)POLYMERS BASF Coatings AG (DE) 2002-04-03 EP disclosed
EP-0925334-B1 AQUEOUS ELECTROPHORETIC ENAMELS, THEIR USE IN PROCESSES FOR COATING ELECTRICALLY CONDUCTIVE SUBSTRATES, AND THE USE OF SILVER IONS AND/OR ELEMENTAL SILVER IN AQUEOUS ELECTROPHORETIC ENAMELS BASF COATINGS AG (DE) 2001-10-31 EP disclosed
WO-2001002498-A1 ELECTRODEPOSITION BATH WITH WATER-SOLUBLE POLYVINYL ALCOHOL (CO)POLYMERS BASF COATINGS AG (DE) 2001-01-11 WO disclosed
EP-0925334-A1 AQUEOUS ELECTROPHORETIC ENAMELS, THEIR USE IN PROCESSES FOR COATING ELECTRICALLY CONDUCTIVE SUBSTRATES, AND THE USE OF SILVER IONS AND/OR ELEMENTAL SILVER IN AQUEOUS ELECTROPHORETIC ENAMELS BASF Coatings Aktiengesellschaft (DE) 1999-06-30 EP disclosed
WO-1998011169-A1 AQUEOUS ELECTROPHORETIC ENAMELS, THEIR USE IN PROCESSES FOR COATING ELECTRICALLY CONDUCTIVE SUBSTRATES, AND THE USE OF SILVER IONS AND/OR ELEMENTAL SILVER IN AQUEOUS ELECTROPHORETIC ENAMELS BASF COATINGS AG (DE) 1998-03-19 WO disclosed