SCHEMBL29043154

SCHEMBL29043154

CCO[Si](CCCCCCCCCCOCC1CO1)(OCC)OCC

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
TDP1 Q9NUW8 1/20 0.62
TSHR P16473 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.56
MAPK1 P28482 1/20 0.37
SPHK2 Q9NRA0 2/20 0.30
SPHK1 Q9NYA1 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
SCHEMBL27498847 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL3130906 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL5647552 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23706418 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23706412 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23706406 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23706415 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23706420 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL10466259 1.00 ALDH1A1 (0.62) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL10590092 0.98 TSHR (0.60) ALDH1A1TDP1TSHRSMN1; SMN2MAPK1

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-116515023-A Composition and cured product 东京应化工业株式会社 2023-08-01 CN disclosed
CN-116514161-A Nanoparticle, nanoparticle dispersion liquid, and method for producing nanoparticle 东京应化工业株式会社 2023-08-01 CN disclosed