SCHEMBL6608458

SCHEMBL6608458

CN(CCC#N)CCC#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LCK P06239 1/20 0.39
TSHR P16473 5/20 0.38
CA12 O43570 1/20 0.37
CA2 P00918 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
MAPT P10636 1/20 0.35
LOX P28300 1/20 0.35
LOXL3 P58215 1/20 0.35

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
SCHEMBL7782415 0.97 ALDH1A1 (0.42) ALDH1A1HPGDTDP1LCKTSHR
SCHEMBL16892353 0.91 CHRM2 (0.42) ALDH1A1HPGDTDP1LCKTSHR
SCHEMBL9797780 0.89 TSHR (0.43) ALDH1A1HPGDTDP1LCKTSHR
SCHEMBL11668526 0.89
SCHEMBL1219354 0.87
SCHEMBL6655057 0.87
SCHEMBL2478663 0.87
SCHEMBL129312 0.85
Hydrochloric Acid SCHEMBL9547197 0.84 ALDH1A1 (0.41) ALDH1A1HPGDTDP1LCKTSHR
SCHEMBL13609722 0.84 TSHR (0.52) ALDH1A1HPGDLCKTSHRCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4549618-A1 PROCESS FOR MAKING AMINES FROM NITRILE COMPOUNDS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY BASF SE (DE) 2025-05-07 EP claimed
EP-4549620-A1 PROCESS FOR MAKING AMINES FROM NITRILE COMPOUNDS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY IN THE ABSENCE OF AMMONIA BASF SE (DE) 2025-05-07 EP claimed
CN-107774331-A A kind of Metal Supported MOFs catalyst and preparation method thereof and the application in PMDPTA synthesis 宿迁市振兴化工有限公司 2018-03-09 CN 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
EP-1094058-B1 Selective reductive amination of nitriles AIR PROD & CHEM (US) 2003-09-03 EP claimed
EP-1215196-A1 Selective reductive amination of nitriles AIR PRODUCTS AND CHEMICALS, INC. (US) 2002-06-19 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-4549620-A1 PROCESS FOR MAKING AMINES FROM NITRILE COMPOUNDS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY IN THE ABSENCE OF AMMONIA BASF SE (DE) 2025-05-07 EP disclosed
EP-4549618-A1 PROCESS FOR MAKING AMINES FROM NITRILE COMPOUNDS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY BASF SE (DE) 2025-05-07 EP disclosed
CN-117323996-A Catalyst for synthesizing N, N-bis (3-aminopropyl) methylamine and preparation method and application thereof 中国石油化工股份有限公司 2024-01-02 CN disclosed
CN-115414942-B Catalyst for synthesizing N, N-bis (3-aminopropyl) methylamine and preparation method and application thereof 中国石油化工股份有限公司 2023-10-31 CN disclosed
US-4967006-A Coproduction of propanediamine and alkylated aminopropylamines AIR PRODUCTS AND CHEMICALS, INC. (US) 1990-10-30 US disclosed
EP-0391349-A2 Coproduction of propanediamine and alkylated aminopropylamines AIR PRODUCTS AND CHEMICALS, INC. (US) 1990-10-10 EP disclosed
US-4142029-A Bis-tetrazoles as chemical blowing agents for foaming thermoplastic resins CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
US-4038210-A BETA-AMINO NITRILE CATALYSTS FOR POLYURETHANE PREPARATION UNION CARBIDE CORPORATION (US) 1977-07-26 US disclosed