SCHEMBL30401593

SCHEMBL30401593

C=Cc1ccc([SiH2]CCC(OC)OC)cc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
TRPA1 O75762 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
SCHEMBL702353 0.86
SCHEMBL16537191 0.78 CHRNB2 (0.36) ALDH1A1TAS1R3TAS1R1CHRNB2CHRNB4
SCHEMBL16537537 0.75 HTT (0.33) ALDH1A1TAS1R3TAS1R1
SCHEMBL707978 0.74
SCHEMBL16537383 0.73 TAS1R3 (0.31) ALDH1A1TAS1R3TAS1R1CHRNB2CHRNB4
SCHEMBL9469817 0.72
SCHEMBL16536377 0.71
SCHEMBL27490756 0.71 ALDH1A1 (0.46) ALDH1A1TAS1R3TAS1R1CHRNB2CHRNB4
SCHEMBL6695340 0.70 TAS1R3 (0.41) ALDH1A1TAS1R3TAS1R1CHRNB2CHRNB4
SCHEMBL1448791 0.69 ALDH1A1 (0.44) ALDH1A1TAS1R3TAS1R1CHRNB2CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119497723-A Conjugated diene polymer, molded article, method for producing conjugated diene polymer, rubber composition, and tire 旭化成株式会社 2025-02-21 CN disclosed
CN-112940364-B Conjugated diene polymer composition and tire 旭化成株式会社 2023-10-03 CN disclosed
CN-113493542-B Conjugated diene polymer, process for producing the same, conjugated diene polymer composition, and rubber composition 旭化成株式会社 2023-09-22 CN disclosed
CN-113372630-B Conjugated diene polymer composition and tire 旭化成株式会社 2023-05-26 CN disclosed