Urethane

Urethane

SCHEMBL28935573

CC(=O)OC(C)C.CCOC(N)=O

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.62
TSHR P16473 4/20 0.58
LMNA P02545 6/20 0.46
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM1 P11229 2/20 0.36
TBXA2R P21731 1/20 0.36
MAPT P10636 2/20 0.35
CHRM5 P08912 1/20 0.35
CHRM3 P20309 1/20 0.35
CYP2C9 P11712 1/20 0.35
GALR3 O60755 1/20 0.35
BLM P54132 1/20 0.35

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
Ethyl Acetate SCHEMBL1528836 0.85 ALDH1A1 (0.67) ALOX15TSHRLMNAALDH1A1HSD17B10
Urethane SCHEMBL21483479 0.81 ALOX15 (0.54) ALOX15TSHRLMNAALDH1A1HSD17B10
Ethyl Acetate SCHEMBL28072193 0.81 ALDH1A1 (0.61) ALOX15TSHRLMNAALDH1A1HSD17B10
Urethane SCHEMBL28091758 0.80 ALOX15 (0.79) ALOX15TSHRLMNAALDH1A1HSD17B10
Urethane SCHEMBL728774 0.80 ALOX15 (0.79) ALOX15TSHRLMNAALDH1A1HSD17B10
Ethyl Acetate SCHEMBL2956427 0.80 ALOX15 (0.79) ALOX15TSHRLMNAALDH1A1HSD17B10
Propane SCHEMBL27531646 0.79 TSHR (0.82) ALOX15TSHRLMNAALDH1A1HSD17B10
Acetamide SCHEMBL16962626 0.79 TSHR (0.82) ALOX15TSHRLMNAALDH1A1HSD17B10
Urethane SCHEMBL5371742 0.79 ALOX15 (0.88) ALOX15TSHRLMNAALDH1A1HSD17B10
Urethane SCHEMBL8505249 0.79 ALOX15 (1.00) ALOX15TSHRLMNAALDH1A1HSD17B10

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
CN-115612120-A Method for preparing novel waterborne polyurethane based on Pickering emulsion method 四川大学 2023-01-17 CN disclosed