SCHEMBL28899385

SCHEMBL28899385

C=C(C)C(=O)C[SiH2]C1CCCCO1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL29065818 0.79
SCHEMBL8934267 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL15161770 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL25379520 0.75
SCHEMBL19409290 0.71 HPGD (0.41) ALDH1A1
SCHEMBL2879832 0.70 KMT2A (0.31)
SCHEMBL5016056 0.70
SCHEMBL103425 0.69
SCHEMBL607281 0.69
SCHEMBL27883948 0.69

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-107254052-B Release agent, preparation method thereof, composite release agent and polyurethane resin material 山东益丰生化环保股份有限公司 2020-09-11 CN disclosed