SCHEMBL7023461

SCHEMBL7023461

CCCC1CNCCN1CCC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.48
SLC6A2 P23975 5/20 0.39
SLC6A4 P31645 5/20 0.39
SLC6A3 Q01959 5/20 0.39
CYP2D6 P10635 4/20 0.39
MITF O75030 1/20 0.33
IDE P14735 2/20 0.33
APAF1 O14727 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
UBE2N P61088 1/20 0.30
GNAO1 P09471 1/20 0.30
GBA1 P04062 1/20 0.30

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
SCHEMBL294941 0.89 TAAR1 (0.44) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL8470487 0.89 TAAR1 (0.44) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL31397702 0.87 TAAR1 (0.45) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL20036401 0.87 TAAR1 (0.45) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL27911335 0.87 TAAR1 (0.54) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL3110597 0.86 TAAR1 (0.43) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL511017 0.85 TAAR1 (0.40) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL28058916 0.84 TAAR1 (0.42) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL28058920 0.84 TAAR1 (0.42) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL4400502 0.84 TAAR1 (0.43) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228449-A1 METHOD FOR PREPARING TERTIARY AMINE WITH SECONDARY AMINE AS RAW MATERIAL ZHEJIANG XINHUA CHEMICAL CO., LTD (CN) 2024-07-11 US disclosed
EP-4324820-A1 METHOD FOR PREPARING TERTIARY AMINE BY USING SECONDARY AMINE AS RAW MATERIAL Zhejiang Xinhua Chemical Co., Ltd. (CN) 2024-02-21 EP disclosed
CN-116478046-A Method for preparing tertiary amine by taking secondary amine as raw material 浙江新化化工股份有限公司 2023-07-25 CN disclosed
CN-109963892-B Curing agent for epoxy resins 亨斯迈石油化学有限责任公司 2023-04-04 CN disclosed
CN-109923145-B Curing agent for epoxy resins 亨斯迈石油化学有限责任公司 2022-11-29 CN disclosed
CN-113600163-B Photocatalyst and application thereof, and preparation method of N-alkyl piperazine and derivatives thereof 厦门大学 2022-06-14 CN disclosed
CN-113600163-A Photocatalyst and application thereof, and preparation method of N-alkyl piperazine and derivatives thereof 厦门大学 2021-11-05 CN disclosed
CN-109963892-A Curing agent for epoxy resin 亨斯迈石油化学有限责任公司 2019-07-02 CN disclosed
CN-109923145-A CURING AGENT FOR EPOXY RESINS 亨斯迈石油化学有限责任公司 2019-06-21 CN disclosed
CN-107935943-A Ester-water amphiphilic hypocrellin derivative and preparation method and application thereof 中国科学院理化技术研究所 2018-04-20 CN disclosed
CN-1654707-A Organometallic compounds ROHM & HAAS ELECT MAT (US) 2005-08-17 CN disclosed
CN-1429804-A Method for preparing sorbic acid LUTNAUVA NUTRIMENT AND FOOD GM (DE) 2003-07-16 CN disclosed
CN-1400214-A Trialkyl VA metal compound HIPELEI INC (US) 2003-03-05 CN disclosed
EP-0789062-B1 WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION SANYO CHEMICAL IND LTD (JP) 2003-01-22 EP disclosed
CN-1352559-A Endoparasiticidal combination BAYER AG (DE) 2002-06-05 CN disclosed
CN-1056858-C Composition for urethane-base plastic lens, urethane-base plastic lens obtained from the composition and process for the production of the plastic lens MITSUI TOATSU CHEMICALS (JP) 2000-09-27 CN disclosed
US-5994421-A CROSSLINKING SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-30 US disclosed
EP-0789062-A1 WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1997-08-13 EP disclosed
CN-1119195-A Composition for urethane-base plastic lens, urethane-base plastic lens obtained from the composition and process for the production of the plastic lens MITSUI TOATSU CHEMICALS (JP) 1996-03-27 CN disclosed
US-4337154-A FORMED FROM A POLYALKYLENIMINE AND A NITROGEN-HETEROCYCLIC SECONDARY AMINE COMPOUND NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1982-06-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240228449-A1 METHOD FOR PREPARING TERTIARY AMINE WITH SECONDARY AMINE AS RAW MATERIAL OTC, AOC1, ODC1 TAAR1 80/4885SLC6A2 255/4885SLC6A4 685/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.