SCHEMBL10839544

SCHEMBL10839544

COC(=O)[C@H]1CN(C)CC[C@H]1c1ccccc1C

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 5/20 0.70
▸ SLC6A4 P31645 5/20 0.70
▸ SLC6A3 Q01959 5/20 0.70

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
SCHEMBL2877591 0.85 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3
SCHEMBL6923261 0.82 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL6923257 0.82 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL3702527 0.81 PDE4B (0.52) SLC6A2SLC6A4SLC6A3
SCHEMBL6831510 0.78 SLC6A2 (0.78) SLC6A2SLC6A4SLC6A3
SCHEMBL6831507 0.78 SLC6A2 (0.78) SLC6A2SLC6A4SLC6A3
SCHEMBL5006473 0.77 ALDH1A1 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL27674744 0.76 SIGMAR1 (0.46) SLC6A2SLC6A4SLC6A3
SCHEMBL20942840 0.76 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3
SCHEMBL18245295 0.76 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3

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-0190496-A2 Piperidine derivatives having a gastro-intestinal activity BEECHAM GROUP PLC (GB) 1986-08-13 — — EP disclosed
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