SCHEMBL1230494

SCHEMBL1230494

CCCC(=N)N

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
Hydrochloric Acid SCHEMBL1886843 0.97
Hydrochloric Acid SCHEMBL7624057 0.97 SPHK2 (0.57)
Water SCHEMBL28096699 0.97
Hydrochloric Acid SCHEMBL1101765 0.97
Bicarbonate SCHEMBL6624249 0.88 SPHK2 (0.50)
Methoxymethane SCHEMBL6965932 0.88 SPHK2 (0.50)
Acetic Acid SCHEMBL17417750 0.86 SPHK2 (0.48)
SCHEMBL1795496 0.80
SCHEMBL3262023 0.80 SPHK2 (0.79)
Trifluoroacetic Acid SCHEMBL4508427 0.78 SPHK2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118717544-A Amino acid ultraviolet protection composition, preparation method and application 江南大学 2024-10-01 CN claimed
CN-118717549-A Amino acid hair dye, preparation method and application 江南大学 2024-10-01 CN claimed
CN-113347973-A VDAC inhibitors for the treatment of autoimmune diseases 国家生物技术研究所公司 2021-09-03 CN claimed
CN-109651260-B Preparation method of 4-amino-5-methoxymethyl-2-propylpyrimidine 山东国邦药业有限公司 2020-10-09 CN claimed
CN-103772239-A Novel amide and amidine derivatives and uses thereof ABBVIE INC 2014-05-07 CN claimed
CN-102459158-A Novel amide and amidine derivatives and use thereof ABBOTT LAB 2012-05-16 CN claimed
US-20100323993-A1 USES OF PENTAMIDINE AND RELATED COMPOUNDS STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF OREGON 2010-12-23 US claimed
WO-2009105691-A2 USES OF PENTAMIDINE AND RELATED COMPOUNDS STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF OREGON (US) 2009-08-27 WO claimed
US-20090194124-A1 Hair Shaping Kit and Process Comprising at Least One Non-Hydroxide Imine MALLE GERARD 2009-08-06 US claimed
US-20090139537-A1 HAIR RELAXING COMPOSITION COMPRISING AT LEAST ONE NON-HYDROXIDE IMINE L'OREAL S.A. 2009-06-04 US claimed
EP-0646038-A4 PASSIVATED AND STABILIZED POROUS SUPPORTS AND METHODS FOR THE PREPARATION AND USE OF SAME. SEPRACOR INC (US) 1995-06-28 EP claimed
WO-1995011014-A1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1995-04-27 WO claimed
EP-0646038-A1 PASSIVATED AND STABILIZED POROUS SUPPORTS AND METHODS FOR THE PREPARATION AND USE OF SAME SEPRACOR, INC. (US) 1995-04-05 EP claimed
WO-1994000214-A1 PASSIVATED AND STABILIZED POROUS SUPPORTS AND METHODS FOR THE PREPARATION AND USE OF SAME SEPRACOR INC. (US) 1994-01-06 WO claimed
EP-0385038-B1 ORTHO-SUBSTITUTED PHENYL AMIDINE AND PHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM The Boots Company PLC (GB) 1993-06-02 EP claimed
EP-0103126-B1 PROCESS FOR PREPARING 4-AMINO-5-DIALKOXYMETHYLPYRIMIDINE DERIVATIVES UBE INDUSTRIES, LTD. (JP) 1987-03-04 EP claimed
US-4522763-A STARTING MATERIALS FOR CROP PROTECTION AGENTS AND SELECTIVE HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-06-11 US claimed
US-4492792-A Process for preparing 4-amino-5-dialkoxy-methylpyrimidine derivatives UBE INDUSTRIES, LTD. (JP) 1985-01-08 US claimed
US-4443629-A AMIDINES, HYDRAZINE HYDRATE, SOLVENTS BAYER AKTIENGESELLSCHAFT (DE) 1984-04-17 US claimed
EP-0103126-A1 Process for preparing 4-amino-5-dialkoxymethylpyrimidine derivatives UBE INDUSTRIES, LTD. (JP) 1984-03-21 EP claimed