SCHEMBL28520516

SCHEMBL28520516

CCO[Si](CCCNC(=O)OCc1ccc(C(=O)O)cc1)(OCC)OCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TGM2 P21980 1/20 0.43
KEAP1 Q14145 3/20 0.43
NFE2L2 Q16236 3/20 0.43
FAAH O00519 1/20 0.42
TPSAB1 Q15661 1/20 0.41
TPSD1 Q9BZJ3 1/20 0.41
TPSG1 Q9NRR2 1/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40

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
SCHEMBL28518922 0.90 ALDH1A1 (0.48) HTTL3MBTL1MAPTLMNASMN1; SMN2
Diethylaniline SCHEMBL28512101 0.89 HTT (0.45) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL2145355 0.88 HTT (0.62) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL6537376 0.84 HTT (0.44) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL13789649 0.84 HTT (0.44) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL1546411 0.83 MAPT (0.52) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL9609731 0.80 TGM2 (0.47) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL17275026 0.79 PRSS1 (0.42) HTTL3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL9609754 0.79 FAAH (0.41) HTTL3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL13896280 0.78 MAPT (0.42) HTTL3MBTL1MAPTLMNASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106536599-B Methosilylized imine and urethane polymerized benzoate compounds, uses and compositions thereof 因特奎姆私人控股公司 2021-01-12 CN disclosed