SCHEMBL987525

SCHEMBL987525

CC(N)CCc1ccc2c(c1)OCO2

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.71
SLC6A4 P31645 3/20 0.71
SLC6A2 P23975 2/20 0.71
SLC6A3 Q01959 2/20 0.71
CYP2D6 P10635 2/20 0.54
CALM1 P0DP23 2/20 0.50
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
TSHR P16473 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CYP3A4 P08684 2/20 0.49

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
SCHEMBL8294114 0.86 TAAR1 (0.61) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL10852152 0.84 SLC6A4 (0.61) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL29661816 0.84 SLC6A4 (0.61) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL2485767 0.83 TAAR1 (0.57) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL29664514 0.83 TAAR1 (0.57) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL28123545 0.83 TAAR1 (0.57) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Tenamfetamine SCHEMBL30904507 0.83 TAAR1 (1.00) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Tenamfetamine SCHEMBL9361151 0.83 TAAR1 (1.00) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Tenamfetamine SCHEMBL15162053 0.83 TAAR1 (1.00) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Tenamfetamine SCHEMBL393456 0.83 TAAR1 (1.00) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6

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 108 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7901949-B2 Assay ALERE SWITZERLAND GMBH (CH) 2011-03-08 US claimed
EP-4351568-A1 HALLUCINOGEN-FATTY ACID COMBINATION Mindset Pharma Inc. (CA) 2024-04-17 EP disclosed
US-20210046014-A1 PHARMACEUTICAL ABUSE DETERRENT COMPOSITION CONSTRUCTED IN MORE THAN ONE STRENGTHS Patel, Jayendrakumar Dasharathlal (IN) 2021-02-18 US disclosed
US-20200368169-A1 ABUSE-DETERRENT COMPOSITIONS PATHEON SOFTGELS INC (US) 2020-11-26 US disclosed
US-10772841-B2 Opioid abuse-deterrent controlled release formulations PATHEON SOFTGELS INC. (US) 2020-09-15 US disclosed
US-10772842-B2 Abuse-deterrent opioids PATHEON SOFTGELS INC. (US) 2020-09-15 US disclosed
CN-105938135-B Analysis device comprising a bubble formation mechanism SPD瑞士精确诊断有限公司 2020-05-05 CN disclosed
US-10478429-B2 Abuse deterrent dosage forms Patheon Softgels, Inc. (US) 2019-11-19 US disclosed
US-10335405-B1 Non-burst releasing pharmaceutical composition Patheon Softgels, Inc. (US) 2019-07-02 US disclosed
WO-2019064082-A2 PHARMACEUTICAL ABUSE DETERRENT COMPOSITION CONSTRUCTED IN MORE THAN ONE STRENGTHS PATEL JAYENDRAKUMAR DASHARATHLAL (IN) 2019-04-04 WO disclosed
EP-1167976-A2 Immunoassay for the detection of amphetamines and derivatives thereof BOEHRINGER MANNHEIM GMBH (DE) 2002-01-02 EP disclosed
US-4751246-A ALPHA(AMINOALKYL)-4-HYDROXY-3-(ALKYLSULFINYL) BENZENEMETHANOL AND 2-(4-HYDROXY-3-(ALKYLSULFINYL) PHENYL)ETHYLAMINE-HYPOTENSIVE AGENTS STERLING DRUG INC. (US) 1988-06-14 US disclosed
EP-0114374-B1 SUBSTITUTED 4-AMINOMETHYLENE CHROMANS OR CHROMENES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN MEDICINES BAYER AG (DE) 1986-07-23 EP disclosed
EP-0168543-A1 (aralkylamino-2-or-propoxy)heterocyclic compounds MERCK & CO. INC. (US) 1986-01-22 EP disclosed
US-4563458-A CIRCULATORY SYSTEM DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 1986-01-07 US disclosed
US-4472427-A (Aralkylamino-2-OR-propoxy)heterocyclic compounds MERCK & CO., INC. (US) 1984-09-18 US disclosed
EP-0114374-A1 Substituted 4-aminomethylene chromans or chromenes, process for their preparation and their use in medicines BAYER AG (DE) 1984-08-01 EP disclosed
US-4452816-A HYPOTENSIVE AND ANTIARRHYTHMIA AGENTS STERLING DRUG INC. (US) 1984-06-05 US disclosed
US-4374149-A HYPOTENSIVE AGENT AND VASODILATOR STERLING DRUG INC. (US) 1983-02-15 US disclosed
US-4221808-A Novel antihypertensive agent RICHARDSON-MERRELL INC. (US) 1980-09-09 US disclosed