SCHEMBL2168641

SCHEMBL2168641

CCCNCCC#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 SCHEMBL5595676 0.97
SCHEMBL151133 0.85
SCHEMBL2167300 0.84
SCHEMBL24638059 0.82 TSHR (0.52)
SCHEMBL2166713 0.82 TSHR (0.62)
Hydrochloric Acid SCHEMBL5595536 0.82 TSHR (0.52)
SCHEMBL11144102 0.82 ALDH1A1 (0.47)
SCHEMBL28584833 0.82 ALDH1A1 (0.47)
SCHEMBL1188228 0.82 ALDH1A1 (0.47)
SCHEMBL11690158 0.80 TSHR (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025119782-A1 METHOD FOR THE MANUFACTURE OF NEW AMINE EVONIK OPERATIONS GMBH (DE) 2025-06-12 WO claimed
US-7521396-B2 Substituted (thioxo)carbonylaminophenyluracils BAYER CROPSCIENCE AG (DE) 2009-04-21 US claimed
US-20060089262-A1 Substituted (thioxo)carbonylamino phenyl uraciles BAYER CROPSCIENCE AG (DE) 2006-04-27 US claimed
EP-1503994-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES Bayer CropScience AG (DE) 2005-02-09 EP claimed
WO-2003093244-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES BAYER CROPSCIENCE AG (DE) 2003-11-13 WO claimed
US-5565602-A REACTING A HYDROCARBYL CHLORIDE WITH A CARBONYL SULFIDE AND AMINE IN PRESENCE OF A BASIC CATALYST PHILLIPS PETROLEUM COMPANY (US) 1996-10-15 US claimed
US-4058390-A Amine salts of phenyl-4-hydroxypyridazines and the preparation and herbicidal compositions thereof CHEMIE LINZ AKTIENGESELLSCHAFT (OE) 1977-11-15 US claimed
EP-4720149-A1 AMINE CATALYSTS FOR POLYURETHANE APPLICATIONS Evonik Operations GmbH (DE) 2026-04-08 EP disclosed
US-12404235-B2 Tricyanohexane purification methods ASCEND PERFORMANCE MATERIALS OPERATIONS LLC (US) 2025-09-02 US disclosed
WO-2025119782-A1 METHOD FOR THE MANUFACTURE OF NEW AMINE EVONIK OPERATIONS GMBH (DE) 2025-06-12 WO disclosed
WO-2024245991-A1 AMINE CATALYSTS FOR POLYURETHANE APPLICATIONS EVONIK OPERATIONS GMBH (DE) 2024-12-05 WO disclosed
US-20240285561-A1 METHODS OF USING PROBENECID FOR TREATMENT OF CORONAVIRUS INFECTIONS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2024-08-29 US disclosed
EP-4386027-A1 SOLVENT-FREE PROCESS TO PRODUCE IMIDE-CONTAINING ISOCYANATE PREPOLYMERS BASF SE (DE) 2024-06-19 EP disclosed
EP-0008475-B1 A PROCESS FOR PREPARING PEROXIDE-BASED BLEACH MEDIA AND CONCENTRATED BLEACH COMPOSITIONS FOR USE IN CARRYING OUT THAT PROCESS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1981-12-16 EP disclosed
US-4199466-A CYANOAMINES SHELL OIL COMPANY (US) 1980-04-22 US disclosed
EP-0008475-A1 A process for preparing peroxide-based bleach media and concentrated bleach compositions for use in carrying out that process SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1980-03-05 EP disclosed
US-4058390-A Amine salts of phenyl-4-hydroxypyridazines and the preparation and herbicidal compositions thereof CHEMIE LINZ AKTIENGESELLSCHAFT (OE) 1977-11-15 US disclosed
US-4052363-A BETA-AMINO PROPIONITRILE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-10-04 US disclosed
US-4025507-A OPTICAL BRIGHTENERS FOR PAPER SANDOZ LTD. (CH) 1977-05-24 US disclosed
US-3931278-A FROM ACETONE AND ACRYLONITRILE, WATER HOECHST AKTIENGESELLSCHAFT (DT) 1976-01-06 US disclosed