Urethane

Urethane

SCHEMBL28924874

C=CC(=O)OCCC12CCCCC1C(=O)NC2=O.CCOC(N)=O

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
ALOX15 P16050 1/20 0.31

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
SCHEMBL206199 0.90 TSHR (0.34) HPGDTSHR
SCHEMBL181719 0.86 SMN1; SMN2 (0.36) HPGDTSHR
SCHEMBL27998201 0.72 TSHR (0.33) HPGDTSHR
Urethane SCHEMBL9064785 0.69 ALOX15 (0.60) HPGDTSHRALOX15
Acrylic Acid Ethyl Ester SCHEMBL1637388 0.67 TSHR (0.38) HPGDTSHR
Urethane SCHEMBL27676158 0.66 TSHR (0.58) HPGDTSHRALOX15
Acrylic Acid Ethyl Ester SCHEMBL8816928 0.66 ALOX15 (0.65) HPGDTSHRALOX15
Urethane SCHEMBL9067342 0.65 TSHR (0.68) HPGDTSHRALOX15
Urethane SCHEMBL28964894 0.65 ALOX15 (0.46) HPGDTSHRALOX15
SCHEMBL28400907 0.64 THRB (0.35) HPGDTSHR

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-113242888-A Active energy ray-curable flexographic printing ink composition 阪田油墨股份有限公司 2021-08-10 CN disclosed