SCHEMBL9759867

SCHEMBL9759867

CO[Si](C)(CCCNc1ccc(C)c(N)c1)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HTT P42858 3/20 0.35
TDP1 Q9NUW8 2/20 0.33
CASP1 P29466 1/20 0.33
MAPT P10636 6/20 0.33
NPC1 O15118 2/20 0.33
LMNA P02545 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 2/20 0.32
STK17A Q9UEE5 1/20 0.32
GAA P10253 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
GFER P55789 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
SCHEMBL4450288 0.87 ALDH1A1 (0.42) ALDH1A1HTTTDP1CASP1MAPT
SCHEMBL960030 0.78 MTNR1A (0.40) ALDH1A1HTTTDP1MAPTLMNA
SCHEMBL9759574 0.77 NQO2 (0.41) ALDH1A1HTTCASP1MAPTLMNA
SCHEMBL2455817 0.77 ALDH1A1 (0.49) ALDH1A1HTTTDP1CASP1MAPT
SCHEMBL8159092 0.77 ALDH1A1 (0.49) ALDH1A1HTTTDP1CASP1MAPT
SCHEMBL9759870 0.75 ALDH1A1 (0.39) ALDH1A1HTTTDP1CASP1MAPT
SCHEMBL9759453 0.74 HDAC6 (0.55) ALDH1A1MAPTCYP3A4GAAKDM4E
SCHEMBL9759830 0.74 HDAC6 (0.42) ALDH1A1HTTTDP1LMNACYP3A4
SCHEMBL3200238 0.74 GAA (0.61) ALDH1A1TDP1MAPTNPC1RAB9A
SCHEMBL29262271 0.74 ABL1 (0.53) ALDH1A1HTTTDP1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4997860-A Amino-substituted silanediol or silanetriol TOSHIBA SILICONE CO., LTD. (JP) 1991-03-05 US claimed
US-4997860-A Amino-substituted silanediol or silanetriol TOSHIBA SILICONE CO., LTD. (JP) 1991-03-05 US disclosed