SCHEMBL28550615

SCHEMBL28550615

[CH2]CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.[LiH]

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.40
CYP3A4 P08684 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL5865018 0.88 SMYD2 (0.38) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL28549731 0.85 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL29142571 0.85 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1879760 0.83 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL23292189 0.83 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL706843 0.81 SMYD2 (0.40) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL17798384 0.81 SMYD2 (0.38) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1316789 0.80 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL437999 0.80 ALDH1A1 (0.39) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL8194768 0.80 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112661891-B Initiator for synthesizing high cis-1, 4-hydroxyl-terminated polybutadiene, preparation method and application thereof 青岛竣翔科技有限公司 2022-05-10 CN claimed
CN-112625159-B Preparation method and application of catalyst for synthesizing hydroxyl-terminated trans-1, 4-polyisoprene polymer 青岛竣翔科技有限公司 2022-05-10 CN claimed
CN-112661891-A Initiator for synthesizing high cis-1, 4-hydroxyl-terminated polybutadiene, preparation method and application thereof 青岛竣翔科技有限公司 2021-04-16 CN claimed
CN-112625159-A Preparation method and application of catalyst for synthesizing hydroxyl-terminated trans-1, 4-polyisoprene polymer 青岛竣翔科技有限公司 2021-04-09 CN claimed
CN-112661891-B Initiator for synthesizing high cis-1, 4-hydroxyl-terminated polybutadiene, preparation method and application thereof 青岛竣翔科技有限公司 2022-05-10 CN disclosed
CN-112625159-B Preparation method and application of catalyst for synthesizing hydroxyl-terminated trans-1, 4-polyisoprene polymer 青岛竣翔科技有限公司 2022-05-10 CN disclosed
CN-112661891-A Initiator for synthesizing high cis-1, 4-hydroxyl-terminated polybutadiene, preparation method and application thereof 青岛竣翔科技有限公司 2021-04-16 CN disclosed
CN-112625159-A Preparation method and application of catalyst for synthesizing hydroxyl-terminated trans-1, 4-polyisoprene polymer 青岛竣翔科技有限公司 2021-04-09 CN disclosed