SCHEMBL435287

SCHEMBL435287

C=CCN(CCC)CCC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
OPRM1 P35372 4/20 0.34
OPRD1 P41143 4/20 0.34
OPRK1 P41145 4/20 0.34
TDP1 Q9NUW8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.31
CRHR1 P34998 1/20 0.31

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
Water SCHEMBL31456245 0.97 TSHR (0.36) TSHRALDH1A1MEN1POLBKMT2A
Hydrochloric Acid SCHEMBL22771642 0.97 TSHR (0.36) TSHRALDH1A1MEN1POLBKMT2A
SCHEMBL213816 0.94 TSHR (0.38) TSHRALDH1A1MEN1POLBKMT2A
Iodide SCHEMBL27887900 0.92 TSHR (0.36) TSHRALDH1A1MEN1POLBKMT2A
Hydrochloric Acid SCHEMBL7265724 0.92 TSHR (0.36) TSHRALDH1A1MEN1POLBKMT2A
Bromide SCHEMBL28746663 0.92 TSHR (0.36) TSHRALDH1A1MEN1POLBKMT2A
Ammonia Solution, Strong SCHEMBL4633238 0.92 TSHR (0.36) TSHRALDH1A1MEN1POLBKMT2A
SCHEMBL18709104 0.90 TSHR (0.40) TSHRALDH1A1MEN1POLBKMT2A
SCHEMBL10580889 0.89 TSHR (0.35) TSHRALDH1A1MEN1POLBKMT2A
SCHEMBL8644002 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107641174-B Copper (II) ion surface imprinted polymer with double exchange of anions and cations and preparation method thereof 淮海工学院 2021-03-12 CN claimed
CN-107641174-A A kind of copper (II) ion surface imprinted polymer of zwitterion double crossing over and preparation method thereof 淮海工学院 2018-01-30 CN claimed
CN-104356298-B Solid phase trace dibit extractant of copper (II) and preparation method thereof 淮海工学院 2016-08-17 CN claimed
CN-104356298-A Solid phase imprinted double-position extraction agent for copper (II) and preparation method of extraction agent HUAIHAI INST TECHNOLOGY 2015-02-18 CN claimed
CN-104177532-A Modified vinyl alcohol-series polymer and its preparation method and use LI RUJI 2014-12-03 CN claimed
CN-102409568-B Preparation method of hydrophilic cationic formaldehyde-free fixing agent UNIV YANTAI 2013-06-19 CN claimed
CN-102409568-A Preparation method of hydrophilic cationic formaldehyde-free color fixing agent UNIV YANTAI 2012-04-11 CN claimed
US-8101703-B2 Precursor solution for polyimide/silica composite material, its manufacture method, and polyimide/silica composite material having low volume shrinkage ETERNAL CHEMICAL CO., LTD (TW) 2012-01-24 US claimed
US-20100297455-A1 PRECURSOR SOLUTION FOR POLYIMIDE/SILICA COMPOSITE MATERIAL, ITS MANUFACTURE METHOD, AND POLYIMIDE/SILICA COMPOSITE MATERIAL HAVING LOW VOLUME SHRINKAGE ETERNAL CHEMICAL CO., LTD. 2010-11-25 US claimed
US-20070078146-A1 Antiinflamamtory agents; antiarthritic agents; inflammatory bowel disorders; multiple sclerosis; asthma PHARMACIA CORPORATION 2007-04-05 US claimed
US-20050245715-A1 Precursor solution for polyimide/silica composite material, its manufacture method, and polymide/silica composite material having low volume shrinkage ETERNAL CHEMICAL CO., LTD. 2005-11-03 US claimed
CN-1394942-A Conveyer belt lubricant-or chain lubricant-concentrate BOWLEYKIN CHEMICAL AG (CH) 2003-02-05 CN claimed
EP-1144403-A1 SUBSTITUED PYRAZOLES AS P38 KINASE INHIBITORS G.D. SEARLE & CO. (US) 2001-10-17 EP claimed
WO-2000031063-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. SEARLE & CO. (US) 2000-06-02 WO claimed
EP-3884019-B1 HOME CARE COMPOSITIONS COLGATE PALMOLIVE CO (US) 2025-09-03 EP disclosed
CN-111757898-B Allylamine copolymer and process for producing the same 日东纺绩株式会社 2022-12-02 CN disclosed
US-11441002-B2 Free standing dispersant film ROHM AND HAAS COMPANY (US) 2022-09-13 US disclosed
EP-0416917-A2 Spinning of acrylic fibres making use of a lubricant composition KAO CORPORATION (JP) 1991-03-13 EP disclosed
US-4734351-A DISPERSION OF POLYMER FUJI PHOTO FILM CO., LTD. (JP) 1988-03-29 US disclosed
EP-0206621-A1 Process for disproportionating silanes MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-12-30 EP 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-20070078146-A1 Antiinflamamtory agents; antiarthritic agents; inflammatory bowel disorders; multiple sclerosis; asthma MAPK1, MAPK3, MAPK4 TSHR 1602/4885ALDH1A1 1079/4885MEN1 3032/4885

“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.