SCHEMBL29205704

SCHEMBL29205704

C=CC(C(=C)C(=O)O)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
BLM P54132 1/20 0.30
SLC6A3 Q01959 1/20 0.30
MEN1 O00255 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL98442 0.78 TSHR (0.33) SLC6A2SLC6A4BLMSLC6A3MEN1
SCHEMBL9337786 0.77 TET2 (0.32) TET2
SCHEMBL22146032 0.71 TSHR (0.35) SLC6A2SLC6A4BLMSLC6A3MEN1
SCHEMBL1948588 0.69
SCHEMBL3771387 0.69 TET2 (0.38) TET2TSHR
SCHEMBL1326397 0.67 LMNA (0.35) TET2SLC6A2SLC6A4BLMSLC6A3
SCHEMBL5543015 0.67 TET2 (0.32) TET2
SCHEMBL9560342 0.67 ALDH1A1 (0.41) TET2
SCHEMBL27948182 0.67 LMNA (0.32) KMT2A
SCHEMBL38691 0.65

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-117677626-A Free radically polymerizable monomers, free radically polymerizable compositions, methods of use, polymerized compositions, and electronic articles 3M创新有限公司 2024-03-08 CN disclosed