SCHEMBL9240709

SCHEMBL9240709

CC(=O)N1C2CCC1C(c1ccc(Cl)cc1)C2

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.54
SLC6A2 P23975 7/20 0.54
SLC6A4 P31645 7/20 0.54

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
SCHEMBL9243087 0.85 SLC6A3 (0.54) SLC6A3SLC6A2SLC6A4
SCHEMBL9239473 0.75 CHRNB2 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL7088777 0.74 SLC6A3 (0.77) SLC6A3SLC6A2SLC6A4
SCHEMBL7281769 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4
SCHEMBL7089372 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4
SCHEMBL7281914 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4
SCHEMBL5000854 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4
SCHEMBL7281917 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4
SCHEMBL7281762 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4
SCHEMBL8694109 0.73 SLC6A3 (0.75) SLC6A3SLC6A2SLC6A4

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
EP-0657455-A1 Epi-epibatidine derivatives, a process and intermediates for preparing them and epi-epibatidine and medicaments containing the epi-epibatidine derivatives and/or epi-epibatidine and the use of them EGIS GYOGYSZERGYAR (HU) 1995-06-14 EP disclosed