SCHEMBL6943568

SCHEMBL6943568

CCOC(=O)NC[Si](CC)(OCC)OCC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 3/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 3/20 0.35
TSHR P16473 1/20 0.35
GLA P06280 1/20 0.35
ALDH1A1 P00352 5/20 0.34
ACHE P22303 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL5916644 0.80 ACHE (0.46) KMT2AGLAACHE
SCHEMBL3401501 0.80 GAA (0.39) SMN1; SMN2GAAMGAMSIMGAM2
SCHEMBL5916672 0.79 ACHE (0.44) KMT2AGLAACHE
SCHEMBL5968316 0.78 GAA (0.38) SMN1; SMN2GAAMGAMSIMGAM2
SCHEMBL8504181 0.78 GAA (0.41) SMN1; SMN2GAAMGAMSIMGAM2
SCHEMBL8504355 0.78 ACHE (0.45) ACHE
SCHEMBL5916592 0.78 ACHE (0.45) ACHE
Ammonia Solution, Strong SCHEMBL28104105 0.77 GAA (0.37) SMN1; SMN2GAAMGAMSIMGAM2
SCHEMBL11136315 0.75 GAA (0.42) SMN1; SMN2GAAMGAMSIMGAM2
SCHEMBL3691270 0.72 KMT2A (0.40) SMN1; SMN2GAAMGAMSIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328586-A1 POLYMERS WITH UREA GROUPS AND SILYL GROUPS AND PRODUCTION AND USE THEREOF Henkel Kommanditgesellschaft auf Aktien (DE) 2003-07-23 EP disclosed
WO-2002050020-A1 METHOD FOR PRODUCING ISOCYANATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-06-27 WO disclosed
WO-2002034838-A1 POLYMERS WITH UREA GROUPS AND SILYL GROUPS AND PRODUCTION AND USE THEREOF HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-05-02 WO disclosed
US-5886205-A Process for producing silicon-containing isocyanate compound TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-23 US disclosed
EP-0864574-A2 Process for producing silicon-containing isocyanate compound TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-16 EP disclosed