Thermine

Thermine

SCHEMBL181589

NCCCNCCCNCCCN

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.86
CA6 P23280 5/20 0.86
CA7 P43166 5/20 0.86
CA9 Q16790 5/20 0.86
CA14 Q9ULX7 5/20 0.86
CA5B Q9Y2D0 5/20 0.86
CA2 P00918 4/20 0.86
CA4 P22748 4/20 0.86
CA5A P35218 4/20 0.86
ALOX15 P16050 3/20 0.86
CASP2 P42575 2/20 0.86
F13A1 P00488 2/20 0.86
CYP1A2 P05177 2/20 0.86
THPO P40225 2/20 0.86
MEN1 O00255 2/20 0.86
RECQL P46063 2/20 0.86
KMT2A Q03164 2/20 0.86
CYP2C19 P33261 1/20 0.86
HSD17B10 Q99714 1/20 0.86
CA3 P07451 3/20 0.80

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
SCHEMBL3159043 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL868754 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL869691 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL561809 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL869672 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL869496 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL870789 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
SCHEMBL869794 1.00 CA12 (0.86) CA12CA6CA7CA9CA14
Thermine SCHEMBL8837088 0.96 CASP2 (0.93) CA12CA6CA7CA9CA14
SCHEMBL9718728 0.96 CASP2 (0.93) CA12CA6CA7CA9CA14

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

Appears in 2267 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4716736-A1 POLYMERS, AQUEOUS COMPOSITIONS COMPRISING SUCH POLYMERS, AND USE AS LAUNDRY DETERGENTS BASF SE (DE) 2026-04-01 EP claimed
US-12550901-B2 Compositions containing glufosinate and a synthetic auxin herbicide CORTEVA AGRISCIENCE LLC (US) 2026-02-17 US claimed
EP-4496840-B1 SURFACE ACTIVATION OF SILICONE HASKOLI ISLANDS (IS) 2026-02-04 EP claimed
EP-3784707-B1 STABLE POLYUREA MICROCAPSULE COMPOSITIONS INT FLAVORS & FRAGRANCES INC (US) 2025-12-24 EP claimed
EP-3478258-B1 CONDITIONER COMPOSITION COMPRISING A CHELANT PROCTER & GAMBLE (US) 2025-11-19 EP claimed
US-12448542-B2 Slurry composition for polishing organic film KCTECH CO., LTD. (KR) 2025-10-21 US claimed
US-20250281617-A1 Drug Delivery System THE UNIVERSITY OF BIRMINGHAM (GB) 2025-09-11 US claimed
US-20250215354-A1 FLUX CLEANING COMPOSITION NAN YA PLASTICS CORPORATION (TW) 2025-07-03 US claimed
US-20250215175-A1 SURFACE ACTIVATION OF SILICONE HASKOLI ISLANDS (IS) 2025-07-03 US claimed
US-12303855-B2 Stable polyurea microcapsule compositions for aldehyde fragrances INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2025-05-20 US claimed
EP-0971027-A1 Amine reaction compounds comprising one or more active ingredient THE PROCTER & GAMBLE COMPANY (US) 2000-01-12 EP claimed
EP-0971021-A1 Process for producing particles of amine reaction product THE PROCTER & GAMBLE COMPANY (US) 2000-01-12 EP claimed
EP-0604097-B1 Ink compositions XEROX CORP (US) 1999-10-13 EP claimed
EP-0943660-A1 DITHIOCARBONATE COMPOSITION Kyowa Yuka Co., Ltd. (JP) 1999-09-22 EP claimed
WO-1999003823-A2 NOVEL POLYAMINE ANALOGUES AS THERAPEUTIC AND DIAGNOSTIC AGENTS ORIDIGM CORPORATION (US) 1999-01-28 WO claimed
US-5759518-A Metal complexes of dendrimeric macromolecules, diagnostics agents that contain the latter as well as process for the production of the complexes and agents SCHERING AKTIENGESELLSCHAFT (DE) 1998-06-02 US claimed
US-5739230-A CURABLE THROUGH A MICHAEL REACTION BETWEEN A COMPONENT HAVING A PLURALITY OF ALPHA,BETA-UNSATURATED CARBONYL GROUPS AND A COMPONENT HAVING A PLURALITY OF ACTIVATED METHYLENE GROUPS NIPPON PAINT CO., LTD. (JP) 1998-04-14 US claimed
US-5330668-A Organic ferromagnetic substance and process for producing same DIRECTOR-GENERAL OF AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) 1994-07-19 US claimed
EP-0604097-A1 Ink compositions XEROX CORPORATION (US) 1994-06-29 EP claimed
US-5254159-A Mixture of water, anionic dye and polyamine XEROX CORPORATION (US) 1993-10-19 US claimed