Urethane

Urethane

SCHEMBL11547426

CC/C(C)=N\O.CCOC(N)=O

nearest known ligand 0.62

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.62
ALDH1A1 P00352 5/20 0.41
LMNA P02545 3/20 0.41
HSD17B10 Q99714 2/20 0.41
SOAT1 P35610 1/20 0.39
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
HPGD P15428 2/20 0.34
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
TSHR P16473 2/20 0.33
CYP2C19 P33261 2/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
MAPT P10636 1/20 0.33

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 SCHEMBL28315970 0.83 ALOX15 (0.68) ALOX15ALDH1A1LMNAHSD17B10SOAT1
Ethyl Acetate SCHEMBL28861254 0.83 ALDH1A1 (0.64) ALOX15ALDH1A1LMNAHSD17B10SOAT1
Urethane SCHEMBL1359706 0.82 ALOX15 (0.94) ALOX15ALDH1A1LMNAHSD17B10SOAT1
Urethane SCHEMBL250833 0.82
Urethane SCHEMBL1359705 0.82 ALOX15 (0.94) ALOX15ALDH1A1LMNAHSD17B10SOAT1
Urethane SCHEMBL6290769 0.82 ALOX15 (0.94) ALOX15ALDH1A1LMNAHSD17B10SOAT1
Urethane SCHEMBL6290773 0.82
Urethane SCHEMBL6001232 0.80 ALOX15 (0.79) ALOX15ALDH1A1LMNAHSD17B10SOAT1
Urethane SCHEMBL8516315 0.80
Carbamic Acid SCHEMBL8556803 0.80 ALDH1A1 (0.41) ALOX15ALDH1A1LMNATSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4173594-A ADDUCTS OF PHENOLIC RESIN BLOCKED ISOCYANATE-TERMINATED POLYURETHANE LORD CORPORATION (US) 1979-11-06 US disclosed