SCHEMBL9315817

SCHEMBL9315817

C=Cc1ccc(OCCCC[SiH](Cl)Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.49
CHRNB2 P17787 1/20 0.49
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
CHRNA4 P43681 1/20 0.49
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 1/20 0.37
KCNA3 P22001 1/20 0.36
PPARA Q07869 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
APP P05067 10/20 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
SCHEMBL1260922 0.85 CHRNA7 (0.61) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8754087 0.83 CHRNB2 (0.59) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1140632 0.83 CHRNB2 (0.59) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9943360 0.81 CHRNA7 (0.61) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4372159 0.80 CHRNB4 (0.50) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL28517708 0.80 CHRNA7 (0.56) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3241666 0.79 CHRNA7 (0.63) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9315366 0.79 ALDH1A1 (0.34) ALDH1A1L3MBTL1
SCHEMBL3562858 0.78 KCNA3 (0.64) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1269642 0.78 CHRNA7 (0.51) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4

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
US-5342983-A Polymer reforming agents SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-08-30 US disclosed