Urethane

Urethane

SCHEMBL7100083

CCOC(N)=O.N=C=O.NC(N)=O

nearest known ligand 0.71

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.71
ALDH1A1 P00352 5/20 0.42
LMNA P02545 4/20 0.40
HSD17B10 Q99714 2/20 0.40
GAA P10253 3/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
SOAT1 P35610 1/20 0.39
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM5 P08912 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
TSHR P16473 2/20 0.37
CHRNB2 P17787 2/20 0.37
CHRNA4 P43681 2/20 0.37
HTR1A P08908 1/20 0.37
CYP2C19 P33261 1/20 0.37
CHRNA7 P36544 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 SCHEMBL10779791 1.00 ALOX15 (0.71) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL11803069 0.98 ALOX15 (0.75) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL1930430 0.98 ALOX15 (0.75) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL27759655 0.98 ALOX15 (0.75) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL370763 0.98
Urethane SCHEMBL11444589 0.98 ALOX15 (0.75) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL26106770 0.93 ALOX15 (0.68) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL28757762 0.93 ALOX15 (0.68) ALOX15ALDH1A1LMNAHSD17B10GAA
Urethane SCHEMBL7174358 0.90
Urethane SCHEMBL6233111 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0816445-B1 Isocyanate-derived materials for use in phase change ink jet inks XEROX CORP (US) 2003-05-02 EP claimed
CN-101319098-B Quinacridone nanoscale pigment particles XEROX CORP 2013-05-22 CN disclosed
CN-101319098-A Quinacridone nanoscale pigment particles XEROX CORP (US) 2008-12-10 CN disclosed
CN-101319097-A Nanosized particles of monoazo laked pigment XEROX CORP (US) 2008-12-10 CN disclosed
EP-0816446-B1 Phase change ink formulation using a urethane and urethane urea isocyanate derived resins XEROX CORP (US) 2003-09-03 EP disclosed
EP-0816446-B1 Phase change ink formulation using a urethane and urethane urea isocyanate derived resins XEROX CORP (US) 2003-09-03 EP disclosed
US-5880174-A CURABLE SYSTEM COMPRISING AS SEPARATE COMPONENTS PHENOLIC RESIN, POLYISOCYANATE MODIFIED WITH ALIPHATIC MONOAMINE ASHLAND INC. (US) 1999-03-09 US disclosed
US-5830942-A Phase change ink formulation using a urethane and urethane/urea isocyanate-derived resins TEKTRONIX, INC. (US) 1998-11-03 US disclosed
WO-1998019808-A1 AMINE MODIFIED POLYISOCYANATES AND THEIR USE IN FOUNDRY BINDER SYSTEMS ASHLAND INC. (US) 1998-05-14 WO disclosed
EP-0816446-A1 Phase change ink formulation using a urethane and urethane urea isocyanate derived resins TEKTRONIX, INC. (US) 1998-01-07 EP disclosed
EP-0816446-A1 Phase change ink formulation using a urethane and urethane urea isocyanate derived resins TEKTRONIX, INC. (US) 1998-01-07 EP disclosed