⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10937689 | 0.97 | — | — | |
| Alcohol SCHEMBL28810798 | 0.88 | ALDH1A1 (0.33) | — | |
| SCHEMBL9998985 | 0.76 | — | — | |
| SCHEMBL83191 | 0.76 | — | — | |
| SCHEMBL1767126 | 0.73 | — | — | |
| SCHEMBL5792559 | 0.73 | — | — | |
| SCHEMBL6346633 | 0.72 | — | — | |
| Water SCHEMBL16162731 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL15348577 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL9998722 | 0.72 | — | — |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6610705-B1 | Treating breast cancer, osteoporosis, hypercholesteremia or endometriosis | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2003-08-26 | — | — | US | claimed |
| EP-0119274-B1 | PROCESS FOR PRODUCING AMINOALKYLSULFONIC ACIDS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1986-11-26 | — | — | EP | claimed |
| US-4507500-A | REACTING A MERCAPTOTHIAZOLINE WITH A HALOGENOETHYLAMINE HYDROHALIDE | MITSUI TOATSU CHEMICALS, INC. (JP) | 1985-03-26 | — | — | US | claimed |
| EP-0119274-A1 | PROCESS FOR PRODUCING AMINOALKYLSULFONIC ACIDS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1984-09-26 | — | — | EP | claimed |
| EP-0044203-B1 | PROCESS FOR PRODUCING 2-MERCAPTOETHYLAMINE HYDROHALIDES | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1984-06-20 | — | — | EP | claimed |
| EP-0044203-A1 | Process for producing 2-mercaptoethylamine hydrohalides | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1982-01-20 | — | — | EP | claimed |
| US-9346832-B2 | Gold complexes for use in the treatment of cancer | UNIVERSITY OF KWAZULU-NATAL (ZA) | 2016-05-24 | — | — | US | disclosed |
| US-20140031334-A1 | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2014-01-30 | — | — | US | disclosed |
| US-8598162-B2 | Derivatives of 4-piperazin-1-yl-4-benzo[B]thiophene suitable for the treatment of CNS disorders | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2013-12-03 | — | — | US | disclosed |
| US-20130090472-A1 | GOLD COMPLEXES FOR USE IN THE TREATMENT OF CANCER | UNIVERSITY OF KWAZULU-NATAL (ZA) | 2013-04-11 | — | — | US | disclosed |
| EP-2287161-B1 | Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders | OTSUKA PHARMA CO LTD (JP) | 2012-05-09 | — | — | EP | disclosed |
| EP-2287162-B1 | Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders | OTSUKA PHARMA CO LTD (JP) | 2012-05-09 | — | — | EP | disclosed |
| EP-2284169-B1 | Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders | OTSUKA PHARMA CO LTD (JP) | 2012-03-14 | — | — | EP | disclosed |
| US-20090264404-A1 | Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of cns disorders | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2009-10-22 | — | — | US | disclosed |
| CN-101258147-A | 4-piperazin-1-yl-4-benzo [ B ] thiophene derivatives for the treatment of CNS disorders | OTSUKA PHARMA CO LTD (JP) | 2008-09-03 | — | — | CN | disclosed |
| EP-1919907-A2 | HETEROCYCLIC COMPOUND | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026959-A2 | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-03-08 | — | — | WO | disclosed |
| US-5997886-A | AQUEOUS CARRIER CONTAINING WATER SOLUBLE LOWER ALIPHATIC ALCOHOLS, ALDEHYDES, KETONES OR ETHERS; STIFFNESS VALUE (SV) AND A CURL RETENTION INDEX (CRI) | THE PROCTER & GAMBLE COMPANY (US) | 1999-12-07 | — | — | US | disclosed |
| US-5191030-A | PROCESS FOR PRODUCING AMINO GROUP TERMINATED POLYPHENYLENE ETHER | MITSUBISHI PETROCHEMICAL CO., LTD. (JP) | 1993-03-02 | — | — | US | disclosed |
| EP-0476619-A2 | Process for producing amino group terminated polyphenylene ether | MITSUBISHI CHEMICAL CORPORATION (JP) | 1992-03-25 | — | — | EP | disclosed |