SCHEMBL28899667

SCHEMBL28899667

[CH2]C(N=C=O)OC(=O)C=C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.32
ALDH1A1 P00352 3/20 0.30
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL28463723 0.81 TSHR (0.33) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL195840 0.78 TSHR (0.39) TSHR
SCHEMBL78843 0.78 TSHR (0.31) TSHR
SCHEMBL1853249 0.77 TSHR (0.36) TSHR
SCHEMBL21409479 0.76 TSHR (0.38) TSHR
SCHEMBL1354420 0.75 TSHR (0.37) TSHR
SCHEMBL28861483 0.75 TSHR (0.37) TSHR
SCHEMBL27799496 0.75 TSHR (0.37) TSHR
SCHEMBL1853247 0.75 TSHR (0.37) TSHR
SCHEMBL29261167 0.73 TSHR (0.37) TSHR

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-107108664-B Sterically hindered amine and alkoxyamine light stabilizers 3M创新有限公司 2020-10-09 CN disclosed