SCHEMBL29124751

SCHEMBL29124751

CCCO[Si](C)(CCCCC1CO1)OCCC

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
EPHX1 P07099 1/20 0.36
SPHK2 Q9NRA0 1/20 0.32
TSHR P16473 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
SCHEMBL28940059 0.90 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2
SCHEMBL3799053 0.86 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2
SCHEMBL1096098 0.85 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TDP1EPHX1
SCHEMBL10465601 0.84 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2
SCHEMBL10463923 0.84 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2
SCHEMBL28493133 0.84 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2TDP1EPHX1
SCHEMBL29175247 0.81 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2
SCHEMBL28264255 0.80 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2
SCHEMBL707266 0.80
SCHEMBL27957417 0.80 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2TDP1EPHX1SPHK2

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-116917370-A Curable resin composition 三键有限公司 2023-10-20 CN disclosed