SCHEMBL8523800

SCHEMBL8523800

CCOC([SiH3])(CC(C)CNc1ccccc1)OCC

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
NR3C2 P08235 1/20 0.31
GAA P10253 2/20 0.31
DNM1 Q05193 1/20 0.31
TSHR P16473 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL825908 0.74 MAPT (0.44) MAPTNPSR1ALDH1A1GAATSHR
SCHEMBL825519 0.74 TDP1 (0.36) SMN1; SMN2NPSR1ALDH1A1TDP1GAA
SCHEMBL489425 0.73 MAPT (0.47) MAPTSMN1; SMN2HTTALDH1A1TDP1
SCHEMBL3687978 0.72 ALDH1A1 (0.50) MAPTSMN1; SMN2HTTNPSR1ALDH1A1
SCHEMBL28477044 0.71 MAPT (0.40) MAPTSMN1; SMN2HTTALDH1A1TDP1
Hydrochloric Acid SCHEMBL17710427 0.71 MAPT (0.46) MAPTSMN1; SMN2HTTALDH1A1TDP1
SCHEMBL9572777 0.70 MAPT (0.44) MAPTSMN1; SMN2HTTALDH1A1TDP1
SCHEMBL14801652 0.68 NPSR1 (0.33) MAPTNPSR1ALDH1A1GAATSHR
SCHEMBL1889198 0.68 MAPT (0.41) MAPTSMN1; SMN2HTTNPSR1ALDH1A1
SCHEMBL10982843 0.68 MAPT (0.50) MAPTSMN1; SMN2HTTALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0676403-B1 Arylaminosilane end-capped urethane sealants WITCO CORP (US) 1999-09-15 EP disclosed