SCHEMBL9595857

SCHEMBL9595857

CC(C(=O)c1cccc(N)c1)N1CCCCC1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 9/20 0.72
▸ SLC6A2 P23975 8/20 0.72
▸ CHRNB4 P30926 6/20 0.72
▸ CHRNA3 P32297 6/20 0.72
▸ CHRNB2 P17787 6/20 0.72
▸ CHRNA4 P43681 6/20 0.72
▸ CHRNA1 P02708 4/20 0.72
▸ CHRNG P07510 4/20 0.72
▸ CHRNB1 P11230 4/20 0.72
▸ CHRND Q07001 4/20 0.72
▸ SLC6A4 P31645 3/20 0.70
▸ ALDH1A1 P00352 3/20 0.62
▸ KDM4E B2RXH2 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ MAOB P27338 1/20 0.50
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ATM Q13315 1/20 0.43
▸ PBRM1 Q86U86 1/20 0.42
▸ NPC1 O15118 1/20 0.41

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
Hydrochloric Acid SCHEMBL9596951 0.99 SLC6A3 (0.70) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL634327 0.82 SLC6A2 (1.00) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL9796926 0.81 SLC6A3 (0.60) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL9360364 0.81 SLC6A3 (0.60) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL1072701 0.81 SLC6A2 (0.69) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL9796810 0.80 SLC6A3 (0.58) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL9797234 0.80 SLC6A3 (0.58) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Hydrochloric Acid SCHEMBL10728832 0.80 SLC6A2 (0.68) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
SCHEMBL9597385 0.80 SLC6A3 (0.61) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2
Bromide SCHEMBL13729160 0.80 SLC6A2 (0.68) SLC6A3SLC6A2CHRNB4CHRNA3CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5236922-A Method for treating depression using 1-(aminophenyl)-2-aminopropanone derivatives LABORATOIRE L. LAFON (FR) 1993-08-17 — — US claimed
EP-0174242-B1 1-(AMINO-PHENYL)-2-AMINO PROPANON DERIVATIVES, THEIR USE IN THERAPY AND PROCESS FOR THEIR PREPARATION LABORATOIRE L. LAFON Société anonyme dite: (FR) 1988-01-13 — — EP claimed
EP-0174242-A2 1-(Amino-phenyl)-2-amino propanon derivatives, their use in therapy and process for their preparation LABORATOIRE L. LAFON Société anonyme dite: (FR) 1986-03-12 — — EP claimed
EP-0174242-B1 1-(AMINO-PHENYL)-2-AMINO PROPANON DERIVATIVES, THEIR USE IN THERAPY AND PROCESS FOR THEIR PREPARATION LABORATOIRE L. LAFON Société anonyme dite: (FR) 1988-01-13 — — EP disclosed
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