SCHEMBL757553

SCHEMBL757553

CCCCN1CCN(C[Si](OC)(OC)OC)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.41
DRD3 P35462 3/20 0.41
GNAI3 P08754 2/20 0.41
GNAO1 P09471 2/20 0.41
GNAI1 P63096 2/20 0.41
MAPK1 P28482 2/20 0.38
HTR2A P28223 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
SCN1A P35498 1/20 0.38
HTR2B P41595 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
HTR1A P08908 2/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL31374750 0.84 DRD2 (0.45) DRD2DRD3GNAI3GNAO1GNAI1
SCHEMBL1229552 0.79 CSNK2A2 (0.35) ALDH1A1USP2LMNA
SCHEMBL1537447 0.78
SCHEMBL18538874 0.78 GNAI3 (0.58) DRD2DRD3GNAI3GNAO1GNAI1
SCHEMBL2318272 0.78 GNAI3 (0.58) DRD2DRD3GNAI3GNAO1GNAI1
SCHEMBL1043894 0.78 GNAI3 (0.58) DRD2DRD3GNAI3GNAO1GNAI1
SCHEMBL26132063 0.76 DRD2 (0.42) DRD2DRD3GNAI3GNAO1GNAI1
SCHEMBL6659463 0.75 GNAI3 (0.62) GNAI3GNAO1GNAI1HRH3LMNA
SCHEMBL6656715 0.75 GNAI3 (0.56) DRD2DRD3GNAI3GNAO1GNAI1
SCHEMBL6658199 0.75 GNAI3 (0.56) DRD2DRD3GNAI3GNAO1GNAI1

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-8137590-B2 Particles comprising zwitterionic structural elements WACKER CHEMIE AG (DE) 2012-03-20 US disclosed
US-20080286628-A1 Particles Comprising Zwitterionic Structural Elements WACKER CHEMIE AG (DE) 2008-11-20 US disclosed