SCHEMBL22462005

SCHEMBL22462005

CN1CCCC1C(O)CSc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 5/20 0.48
CHRNA3 P32297 5/20 0.48
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA4 P43681 1/20 0.41
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL22462006 1.00 CHRNB4 (0.48) CHRNB4CHRNA3ALDH1A1SMN1; SMN2CHRNB2
SCHEMBL22461936 0.78 SLC6A1 (0.38) KDM4ENPC1RAB9A
SCHEMBL7306648 0.76 ALDH1A1 (0.44) ALDH1A1NPC1
SCHEMBL7270911 0.74 CHRNB4 (0.47) CHRNB4CHRNA3ALDH1A1HSD17B10
SCHEMBL16902660 0.73 CHRNB4 (0.47) CHRNB4CHRNA3CHRNB2CHRNA7CHRNA4
SCHEMBL16902659 0.73 CHRNB4 (0.47) CHRNB4CHRNA3CHRNB2CHRNA7CHRNA4
SCHEMBL30467247 0.72 CHRNB4 (0.39) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL754993 0.72 CHRNB4 (0.39) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL21566378 0.72 CHRNB4 (0.46) CHRNB4CHRNA3ALDH1A1SMN1; SMN2NPC1
SCHEMBL2951287 0.72 NPC1 (0.53) ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A

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
WO-2020191252-A1 TECHNOLOGIES USEFUL FOR OLIGONUCLEOTIDE PREPARATION WAVE LIFE SCIENCES LTD. (SG) 2020-09-24 WO disclosed