SCHEMBL10678669

SCHEMBL10678669

O=C1NCC[C@@H](c2ccc(O)cc2)[C@@H]1c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 10/20 0.52
▸ SLC6A2 P23975 7/20 0.46
▸ SLC6A4 P31645 2/20 0.43
▸ ESR2 Q92731 2/20 0.42
▸ ESR1 P03372 1/20 0.42
▸ DEGS1 O15121 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NISCH Q9Y2I1 1/20 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
SCHEMBL10678651 1.00 SLC6A3 (0.52) SLC6A3SLC6A2SLC6A4ESR2ESR1
SCHEMBL10678658 1.00 SLC6A3 (0.52) SLC6A3SLC6A2SLC6A4ESR2ESR1
SCHEMBL10671944 0.91 SLC6A3 (0.57) SLC6A3SLC6A2SLC6A4NISCH
SCHEMBL10672415 0.85 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL10678871 0.85 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL10676588 0.85 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL10676578 0.85 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL10678885 0.85 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL10671203 0.85 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL10672425 0.85 SLC6A3 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4785007-A ANTIDEPRESSANTS, P LABORATOIRES HOECHST S.A. (FR) 1988-11-15 — — US disclosed
EP-0203308-A2 2,3- Or 3,4-diphenyl-gamma-nitrile-ester derivatives for the treatment of kidney insufficiency, and their ring-closure products as psychostimulating and antidepressive medicaments LABORATOIRES HOECHST S.A. (FR) 1986-12-03 — — EP disclosed
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