SCHEMBL29249229

SCHEMBL29249229

CCCCCCCCNCO[Si](C)(CCC)OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
EPHX1 P07099 8/20 0.38
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
S1PR2 O95136 5/20 0.33
S1PR4 O95977 5/20 0.33
S1PR1 P21453 5/20 0.33
S1PR3 Q99500 5/20 0.33
S1PR5 Q9H228 1/20 0.33
LMNA P02545 1/20 0.32
CASP2 P42575 1/20 0.31
RELA Q04206 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
SCHEMBL28041977 0.93 TSHR (0.37) ALDH1A1TSHR
SCHEMBL28030996 0.89 CA12 (0.35) ALDH1A1TSHREPHX1LMNACASP2
SCHEMBL18186141 0.85 ALDH1A1 (0.52) ALDH1A1TSHREPHX1ADH1BADH1C
SCHEMBL3689590 0.84 CA12 (0.31) ALDH1A1LMNA
Dipentylamine SCHEMBL18186132 0.83 TSHR (0.54) ALDH1A1TSHREPHX1ADH1BADH1C
SCHEMBL28840184 0.83 MEN1 (0.30)
SCHEMBL29140672 0.81 ALDH1A1 (0.41) ALDH1A1TSHREPHX1ADH1BADH1C
SCHEMBL28031002 0.80 ACHE (0.34) ALDH1A1TSHR
SCHEMBL30998847 0.78 ALDH1A1 (0.52) ALDH1A1TSHREPHX1ADH1BADH1C
SCHEMBL16829915 0.78 ALDH1A1 (0.52) ALDH1A1TSHREPHX1ADH1BADH1C

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-118043332-A Method for producing cyclic silazane compound 信越化学工业株式会社 2024-05-14 CN disclosed