SCHEMBL28504693

SCHEMBL28504693

C#CCOCCC(C)(C)OC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL28510293 0.79 TSHR (0.38) TSHR
SCHEMBL27502516 0.78 LMNA (0.33) LMNAHSD17B10
SCHEMBL3075311 0.75 HSD17B10 (0.34) LMNAHSD17B10
SCHEMBL17956497 0.74 LMNA (0.35) TSHRLMNAHSD17B10
SCHEMBL16013251 0.74 LMNA (0.31) LMNAHSD17B10
SCHEMBL12168462 0.72 LMNA (0.34) LMNAHSD17B10
SCHEMBL28887202 0.71 TSHR (0.37) TSHR
SCHEMBL23547936 0.70 TSHR (0.34) TSHR
Urea SCHEMBL29104387 0.70 TSHR (0.48) TSHRLMNAHSD17B10
SCHEMBL13737752 0.70 TSHR (0.48) TSHRLMNAHSD17B10

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-112105385-A IRAK degrading agents and uses thereof 凯麦拉医疗公司 2020-12-18 CN disclosed