SCHEMBL4941372

SCHEMBL4941372

C[Si](C)(C)O[Si](C)(CCCN1CCOCC1)O[Si](C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HPGD P15428 1/20 0.43
DUSP3 P51452 1/20 0.43
ALDH1A1 P00352 4/20 0.42
SIGMAR1 Q99720 3/20 0.42
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
HTR2A P28223 1/20 0.42
SCN1A P35498 1/20 0.42
HTR2B P41595 1/20 0.42
KCNH2 Q12809 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN3A Q9NY46 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
LMNA P02545 3/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 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
SCHEMBL31687716 0.86 SMN1; SMN2 (0.44) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL31687721 0.86 SMN1; SMN2 (0.44) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL4934531 0.85 HRH3 (0.43) SMN1; SMN2ALDH1A1MAPK1CYP1A2KCNH2
SCHEMBL31687711 0.84 SMN1; SMN2 (0.46) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL612240 0.83 SMN1; SMN2 (0.48) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL29496667 0.83 HRH3 (0.46) SMN1; SMN2MAPK1CYP1A2KCNH2HRH3
SCHEMBL31687749 0.83 ALDH1A1 (0.42) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL612357 0.80 SMN1; SMN2 (0.46) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL13532385 0.78 KEAP1 (0.56) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1
SCHEMBL3482540 0.76 SMN1; SMN2 (0.48) KEAP1SMN1; SMN2HPGDDUSP3ALDH1A1

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
JP-56022732-A None JP disclosed
CN-219677088-U Intelligent switch of high security 深圳市聪讯智能科技有限公司 2023-09-12 CN disclosed
US-20080075981-A1 Magnetic recording medium HITACHI MAXELL, LTD. (JP) 2008-03-27 US disclosed
JP-S5622732-A ANTITUMOR AGENT COMPOSED MAINLY OF ORGANIC SILICON COMPOUND SHIN ETSU CHEM CO LTD 1981-03-03 JP disclosed