SCHEMBL3825931

SCHEMBL3825931

CC(c1ccc(Cl)cc1)C1CCCN1C

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.47
SLC6A4 P31645 3/20 0.47
SLC6A3 Q01959 2/20 0.47
CHRNB4 P30926 6/20 0.46
CHRNA3 P32297 6/20 0.46
CHRM1 P11229 1/20 0.42
CHRNB2 P17787 2/20 0.40
CHRNA4 P43681 2/20 0.40
CHRNA5 P30532 1/20 0.40
CHRNA7 P36544 1/20 0.40

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
SCHEMBL16457227 0.81 OPRM1 (0.47) SLC6A2SLC6A4SLC6A3CHRNB4CHRNA3
SCHEMBL31575348 0.76 CHRNB2 (0.43) SLC6A2SLC6A4SLC6A3CHRNB4CHRNA3
SCHEMBL31575359 0.76 CHRNB2 (0.43) SLC6A2SLC6A4SLC6A3CHRNB4CHRNA3
SCHEMBL10112661 0.73 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3CHRNB2CHRNA4
SCHEMBL31575328 0.72 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3CHRM1CHRNB2
SCHEMBL30166180 0.72 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3CHRM1CHRNB2
SCHEMBL24245936 0.71 CHRNB4 (0.51) SLC6A2SLC6A4SLC6A3CHRNB4CHRNA3
SCHEMBL18610254 0.71 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3CHRNB4CHRNA3
SCHEMBL12261486 0.71 SLC6A4 (0.59) SLC6A2SLC6A4SLC6A3CHRM1
SCHEMBL14471693 0.70 CHRNB4 (0.63) SLC6A2SLC6A4SLC6A3CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280970-B1 IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2014-01-08 EP disclosed
WO-2009132986-A1 IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-11-05 WO disclosed