SCHEMBL31142001

SCHEMBL31142001

CC(C#N)CCOCC(F)F

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46

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
SCHEMBL17986913 0.79
SCHEMBL16121041 0.76
SCHEMBL130953 0.75 ALDH1A1 (0.37)
SCHEMBL8750877 0.74 TSHR (0.44) TSHR
SCHEMBL31142004 0.73 TSHR (0.45) TSHR
SCHEMBL29088266 0.73
SCHEMBL10936380 0.72 TSHR (0.40) TSHR
SCHEMBL1989818 0.72
SCHEMBL25456013 0.71
SCHEMBL19316269 0.70 HSD17B10 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598774-B Cyanoethyl ether compound and preparation method and application thereof 上海如鲲新材料股份有限公司 2024-11-26 CN disclosed
CN-118598774-A Cyanoethyl ether compound and preparation method and application thereof 上海如鲲新材料股份有限公司 2024-09-06 CN disclosed