SCHEMBL298413

SCHEMBL298413

CCN(CC)C(C)C#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 SCHEMBL10492850 0.97 TSHR (0.35)
SCHEMBL21162352 0.85 CYP1A2 (0.39)
Nitric Acid SCHEMBL14696448 0.82 CA5A (0.32)
SCHEMBL11675330 0.78 FDPS (0.34)
SCHEMBL7137696 0.78 PGR (0.34)
SCHEMBL19226113 0.78 CHRM2 (0.33)
SCHEMBL2560546 0.74 CYP1A2 (0.44)
SCHEMBL16580145 0.74 CYP1A2 (0.44)
SCHEMBL1582129 0.74 CYP1A2 (0.44)
SCHEMBL20414866 0.74

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
US-20230081986-A1 METHOD AND REAGENTS TO IMPROVE NONANIMAL OCULAR TOXICITY TESTS LEBRUN LABS LLC (US) 2023-03-16 US claimed
EP-2330174-B1 Organic-inorganic hybrid transparent hydrogel complex for fire retardant glass, fire retardant glass assembly using the same, and manufacturing method thereof SAMGONG CO LTD (KR) 2014-07-23 EP claimed
US-8663788-B2 Organic-inorganic hybrid transparent hydrogel complex for fire retardant glass, fire retardant glass assembly using the same, and manufacturing method thereof SAMGONG CO., LTD. (KR) 2014-03-04 US claimed
CN-102086293-B Organic-inorganic hybrid transparent hydrogel complex for fire retardant glass, fire retardant glass assembly using the same, and manufacturing method thereof SAMGONG CO LTD 2013-03-06 CN claimed
US-20110135896-A1 ORGANIC-INORGANIC HYBRID TRANSPARENT HYDROGEL COMPLEX FOR FIRE RETARDANT GLASS, FIRE RETARDANT GLASS ASSEMBLY USING THE SAME, AND MANUFACTURING METHOD THEREOF SAMGONG CO., LTD. (KR) 2011-06-09 US claimed
EP-2330174-A1 Organic-inorganic hybrid transparent hydrogel complex for fire retardant glass, fire retardant glass assembly using the same, and manufacturing method thereof Samgong Co., Ltd. (KR) 2011-06-08 EP claimed
CN-102086293-A Organic-inorganic hybrid transparent hydrogel complex for fire retardant glass, fire retardant glass assembly using the same, and manufacturing method thereof SAMGONG CO LTD 2011-06-08 CN claimed
US-6743564-B2 A POSITIVE RESIST FORMULATION CONSISTS OF NITRILE CONTAINING TERT-AMINE COMPOUND, AN ORGANIC SOLVENT AND A BASE RESIN HAVING AN ACIDIC FUNCTIONAL GROUP WHICH IS PROTECTED WITH AN ACID LABILE GROUP, A PHOTOACID GENERATOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-06-01 US claimed
EP-1215196-B1 Selective reductive amination of nitriles AIR PROD & CHEM (US) 2004-05-12 EP claimed
EP-0913388-B1 Hydrogenation of nitriles to produce amines AIR PROD & CHEM (US) 2003-10-01 EP claimed
US-6399830-B1 USING CATALYST AIR PRODUCTS AND CHEMICALS, INC. 2002-06-04 US claimed
US-6248925-B1 REACTING A NITRILE WITH A PRIMARY OR SECONDARY AMINE EFFECTING CONVERSION OF THE NITRILE GROUP TO THE CORRESPONDING SECONDARY OR TERTIARY AMINE; PROMOTIONALLY EFFECTIVE AMOUNT OF A LITHIUM COMPOUND OR SODIUM CHLORIDE. AIR PRODUCTS AND CHEMICALS, INC. 2001-06-19 US claimed
EP-1094058-A1 Selective reductive amination of nitriles AIR PRODUCTS AND CHEMICALS, INC. (US) 2001-04-25 EP claimed
EP-0913388-A1 Hydrogenation of nitriles to produce amines AIR PRODUCTS AND CHEMICALS, INC. (US) 1999-05-06 EP claimed
US-5869653-A USING SPONGE OR RANEY COBALT CATALYST; AMMONIA-FREE REACTION AIR PRODUCTS AND CHEMICALS, INC. (US) 1999-02-09 US claimed
EP-0470008-B1 Polymerisable compositions and use of these compositions for the sealing of underground media RHONE POULENC CHIMIE (FR) 1994-10-12 EP claimed
US-5250645-A Methoxypolyalkoxyethyl methacrylate or acrylate, an initiator, polymerization accelerator and water RHONE-POULENC CHIMIE (FR) 1993-10-05 US claimed
EP-0470008-A1 Polymerisable compositions and use of these compositions for the sealing of underground media RHONE-POULENC CHIMIE (FR) 1992-02-05 EP claimed
EP-0214056-B1 FIREPROOF GLAZING SAINT-GOBAIN VITRAGE INTERNATIONAL (FR) 1991-05-22 EP claimed
US-4830913-A HYDROGEL, METAL HALIDE, CORROSION RESISTANCT COMPOUND ADDITIVE SAINT-GOBAIN VITRAGE (FR) 1989-05-16 US claimed