SCHEMBL3712866

SCHEMBL3712866

CO[Si](CCCNN1CCOCC1)(OC)OC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.34
KDM1A O60341 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.32
HTT P42858 2/20 0.32
GLA P06280 1/20 0.32
CYP2C19 P33261 1/20 0.31
HPGD P15428 1/20 0.31
DUSP3 P51452 1/20 0.31
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL3699860 0.86 KDM1A (0.33) HTR4KDM1ATDP1HTTGLA
SCHEMBL935171 0.83 HTT (0.36) KDM1AHTTGNAI3GNAO1GNAI1
SCHEMBL935537 0.79 GNAI3 (0.53) GNAI3GNAO1GNAI1
SCHEMBL3706388 0.78 HTR4 (0.34) HTR4KDM1AGLACYP2C19ALDH1A1
SCHEMBL3709883 0.77 HTT (0.36) KDM1AHTTGNAI3GNAO1GNAI1
SCHEMBL14467701 0.77 TDP1 (0.41) HTR4KDM1ATDP1HTTGLA
SCHEMBL30998792 0.76 TDP1 (0.46) KDM1ATDP1LMNACYP2C19HPGD
SCHEMBL33525084 0.74 HTT (0.63) HTTGLAALDH1A1
SCHEMBL4721218 0.74 HTT (0.49) KDM1ALMNAHTTHPGDGNAI3
SCHEMBL125043 0.73 SMN1; SMN2 (0.48) TDP1LMNAHPGDDUSP3CYP2D6

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-8357755-B2 Cross-linkable organosilicon-based compositions WACKER CHEMIE AG (DE) 2013-01-22 US disclosed
US-20120123048-A1 CROSS-LINKABLE ORGANOSILICON-BASED COMPOSITIONS WACKER CHEMIE AG (DE) 2012-05-17 US disclosed