SCHEMBL3383380

SCHEMBL3383380

CCCCNCCC[Si](OC)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.42
DRD4 P21917 9/20 0.42
DRD3 P35462 7/20 0.42
SIGMAR1 Q99720 1/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LTA4H P09960 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALOX12 P18054 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
HDAC3 O15379 1/20 0.36

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
SCHEMBL3386839 0.97 DRD2 (0.42) DRD2DRD4DRD3SIGMAR1KMT2A
SCHEMBL3385240 0.92 SIGMAR1 (0.45) DRD2DRD4DRD3SIGMAR1KMT2A
SCHEMBL3354992 0.89 DRD2 (0.40) DRD2DRD4DRD3HTTCYP1A2
SCHEMBL1608986 0.87 LTA4H (0.43) DRD2DRD3KMT2AGAAMAPT
SCHEMBL3350037 0.86 DRD2 (0.40) DRD2DRD4DRD3HTTCYP1A2
SCHEMBL19816665 0.84 LTA4H (0.43) DRD2DRD3KMT2AGAAMAPT
Toluene SCHEMBL28340618 0.83 DRD2 (0.43) DRD2DRD4DRD3SIGMAR1KMT2A
SCHEMBL19816823 0.82 LTA4H (0.43) DRD2DRD3KMT2AGAAMAPT
SCHEMBL25395317 0.81 LTA4H (0.42) DRD2DRD3HTTALDH1A1LTA4H
SCHEMBL31187713 0.81 LTA4H (0.42) DRD2DRD3HTTALDH1A1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100010166-A1 SILANE-TERMINATED PREPOLYMERS AND RELATIVE ADHESIVE SEALANT FORMULATIONS N.P.T. S.R.L. (IT) 2010-01-14 US disclosed
EP-2064256-A1 SILANE-TERMINATED PREPOLYMERS AND RELATIVE ADHESIVE SEALANT FORMULATIONS N.P.T. S.R.L. (IT) 2009-06-03 EP disclosed
WO-2008031895-A1 SILANE-TERMINATED PREPOLYMERS AND RELATIVE ADHESIVE SEALANT FORMULATIONS N.P.T. S.R.L. (IT) 2008-03-20 WO disclosed