SCHEMBL8759529

SCHEMBL8759529

C=Cc1ccc(COCCCC[SiH](OCC)OCC)cc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL8759065 0.86 TDP1 (0.38) TDP1L3MBTL1CHRNB2CHRNB4CHRNA3
SCHEMBL316600 0.82 ALDH1A1 (0.46) TDP1L3MBTL1CHRNB2CHRNB4CHRNA3
SCHEMBL1269642 0.81 CHRNA7 (0.51) L3MBTL1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL28340938 0.81 ALDH1A1 (0.35) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL10961584 0.81 L3MBTL1 (0.47) TDP1L3MBTL1ALDH1A1
SCHEMBL1664388 0.81 CA1 (0.40) TDP1L3MBTL1CHRNB2CHRNB4CHRNA3
SCHEMBL18868387 0.80 ALDH1A1 (0.44) TDP1L3MBTL1CHRNB2CHRNB4CHRNA3
SCHEMBL9315366 0.80 ALDH1A1 (0.34) TDP1L3MBTL1ALDH1A1
SCHEMBL23727557 0.79 CA1 (0.42) TDP1L3MBTL1CHRNB2CHRNB4CHRNA3
SCHEMBL4303930 0.79 CA1 (0.42) TDP1L3MBTL1CHRNB2CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5326895-A 3-(vinylbenzyloxy)propylsilane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-07-05 US claimed
EP-0494549-B1 3-(Vinylbenzyloxy)propylsilane compounds and their preparation SHINETSU CHEMICAL CO (JP) 1997-05-28 EP disclosed
US-5326895-A 3-(vinylbenzyloxy)propylsilane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-07-05 US disclosed
EP-0494549-A1 3-(Vinylbenzyloxy)propylsilane compounds, their preparation and polymers thereof Shin-Etsu Chemical Co., Ltd. (JP) 1992-07-15 EP disclosed