SCHEMBL232544

SCHEMBL232544

CCC(N(C)C)N1CN(C(CC)N(C)C)CN(C(CC)N(C)C)C1

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
Carbamic Acid SCHEMBL29017604 0.85 TDP1 (0.31)
SCHEMBL27699520 0.83
SCHEMBL29905540 0.79
SCHEMBL9341620 0.76
SCHEMBL5377836 0.75
SCHEMBL11552775 0.74 ALDH1A1 (0.37)
SCHEMBL1856620 0.74
SCHEMBL4062953 0.74 OPRD1 (0.34)
SCHEMBL19920792 0.71 SLC6A2 (0.31)
SCHEMBL9106715 0.71 SHBG (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773755-B1 PROCESS FOR THE PRODUCTION OF POLYISOCYANATES HUNTSMAN INT LLC (US) 2012-10-31 EP claimed
US-7470762-B2 Living radical polymerization of acrylic monomers and the formation of block copolymers therefrom UNIVERSITY OF PENNSYLVANIA (US) 2008-12-30 US claimed
US-7345127-B2 Living radical polymerization of halogen-containing and acrylic monomers and the formation of block copolymers therefrom UNIVERSITY OF PENNSYLVANIA (US) 2008-03-18 US claimed
US-20080039601-A1 Living radical polymerization of halogen-containing and acrylic monomers and the formation of block copolymers therefrom UNIVERSITY OF PENNSYLVANIA 2008-02-14 US claimed
EP-1254187-B1 LOW MONOMER FOAM BAXENDEN CHEM (GB) 2006-10-18 EP claimed
US-20050131186-A1 Living radical polymerization of halogen-containing and acrylic monomers and the formation of block copolymers therefrom PENNSYLVANIA, UNIVERSITY OF 2005-06-16 US claimed
US-6774270-B1 HEATING FLUID TO ISOMERIZE DIMERS TO THERMODYNAMIC ISOMER; CONTACTING WITH TERTIARY AMINE TO FORM ADDUCT; SEPARATION 3M INNOVATIVE PROPERTIES COMPANY 2004-08-10 US claimed
US-5240964-A Adding piperazine catalyst with imidazole, triazine or amidine compound to create difference in gas evolution between inner and outer parts of plastic liquid TOKYO SEAT CO., LTD. (JP) 1993-08-31 US claimed
US-5141684-A Using catalyst which creates difference in gas evolution between inner and outer parts of plastic liquid in mold to form high density layer on outer surface TOKYO SHEET CO., LTD. (JP) 1992-08-25 US claimed
US-4025469-A MIXTURE OF A HEXAHYDROTRIAZINE WITH A TETRAHYDROOXADIAZINE ARMSTRONG CORK COMPANY (US) 1977-05-24 US claimed
JP-3033120-A None JP disclosed
JP-56050918-A None JP disclosed
JP-63260915-A None JP disclosed
JP-3068617-A None JP disclosed
EP-4685171-A1 CURABLE COMPOUND, CURABLE RESIN COMPOSITION, CURED PRODUCT, AND LAMINATE DIC Corporation (JP) 2026-01-28 EP disclosed
US-4129697-A Process for the production of thermoformable polyisocyanurate foams BAYER AKTIENGESELLSCHAFT (DE) 1978-12-12 US disclosed
US-4113945-A 3,5-BIS(N,N-DIALKYLAMINOALKYL)-1,3,5-TETRAHYDROOXADIAZINE ARMSTRONG CORK COMPANY (US) 1978-09-12 US disclosed
US-4055522-A AROMATIC ALDEHYDE, TRIMERIZATION CATALYST MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1977-10-25 US disclosed
US-4025469-A MIXTURE OF A HEXAHYDROTRIAZINE WITH A TETRAHYDROOXADIAZINE ARMSTRONG CORK COMPANY (US) 1977-05-24 US disclosed
JP-H00333120-A 0001-01-01 JP disclosed