SCHEMBL8961990

SCHEMBL8961990

C=CCc1ccccc1O[Si](C)(CCC(N)CCN)OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.37
ADRB2 P07550 5/20 0.37
ALDH1A1 P00352 1/20 0.36
ADRA2C P18825 5/20 0.36
ADRA2A P08913 4/20 0.36
ADRA2B P18089 4/20 0.36
KCNH2 Q12809 2/20 0.36
ADRB1 P08588 4/20 0.35
LMNA P02545 2/20 0.35
ADRB3 P13945 2/20 0.35
SLC6A2 P23975 1/20 0.35
BDKRB2 P30411 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
KDM4E B2RXH2 2/20 0.35

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
SCHEMBL8962071 0.94 HTR1A (0.39) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8962155 0.87 HTR1A (0.38) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8961858 0.84 HTR1A (0.40) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8962096 0.73 KDM4E (0.39) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8961860 0.73 KDM4E (0.39) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8961940 0.70 ALDH1A1 (0.47) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL29699897 0.70 ALDH1A1 (0.47) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8961842 0.70 ALDH1A1 (0.47) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8961866 0.70 ALDH1A1 (0.40) HTR1AADRB2ALDH1A1ADRA2CADRA2A
SCHEMBL8962100 0.70 ALDH1A1 (0.40) HTR1AADRB2ALDH1A1ADRA2CADRA2A

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
EP-0564275-B1 Antifouling paint NIPPON PAINT CO LTD (JP) 1996-01-31 EP disclosed
US-5332431-A Alkylphenoxy group containing organosilicon compound NIPPON PAINT CO., LTD. (JP) 1994-07-26 US disclosed
EP-0564275-A1 Antifouling paint NIPPON PAINT CO., LTD. (JP) 1993-10-06 EP disclosed