SCHEMBL935171

SCHEMBL935171

CCO[Si](CCCNN1CCOCC1)(OCC)OCC

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.36
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
KDM1A O60341 1/20 0.32
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 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
SCHEMBL3709883 0.87 HTT (0.36) HTTGNAI3GNAO1GNAI1KDM1A
SCHEMBL3712866 0.83 HTR4 (0.34) HTTGNAI3GNAO1GNAI1KDM1A
SCHEMBL934568 0.81 GNAI3 (0.54) GNAI3GNAO1GNAI1
SCHEMBL935658 0.80 TSHR (0.34) HTTMAPK1SMN1; SMN2TSHRALDH1A1
SCHEMBL3699860 0.77 KDM1A (0.33) HTTGNAI3GNAO1GNAI1KDM1A
SCHEMBL4721218 0.75 HTT (0.49) HTTGNAI3GNAO1GNAI1KDM1A
SCHEMBL612716 0.75 SMN1; SMN2 (0.46) HTTMAPK1SMN1; SMN2TSHRALDH1A1
SCHEMBL28862350 0.73 ALDH1A1 (0.44) HTTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL2616667 0.73 TDP1 (0.49) SMN1; SMN2TSHRALDH1A1GAA
SCHEMBL3703407 0.73 TSHR (0.34) HTTMAPK1SMN1; SMN2TSHRALDH1A1

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
US-8357755-B2 Cross-linkable organosilicon-based compositions WACKER CHEMIE AG (DE) 2013-01-22 US disclosed
EP-2454326-A1 CROSS-LINKABLE ORGANOSILICON-BASED COMPOSITIONS Wacker Chemie AG (DE) 2012-05-23 EP disclosed
US-20120123048-A1 CROSS-LINKABLE ORGANOSILICON-BASED COMPOSITIONS WACKER CHEMIE AG (DE) 2012-05-17 US disclosed
WO-2011006808-A1 CROSS-LINKABLE ORGANOSILICON-BASED COMPOSITIONS WACKER CHEMIE AG (DE) 2011-01-20 WO disclosed