SCHEMBL65324

SCHEMBL65324

N#CCCN(CCO)CCC#N

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.50
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 2/20 0.30
LOX P28300 1/20 0.30
LOXL3 P58215 1/20 0.30
LOXL2 Q9Y4K0 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
DRD3 P35462 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALOX15 P16050 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL64977 1.00 LCK (0.50) LCKALDH1A1TDP1NPC1L3MBTL1
SCHEMBL11380835 0.97 LCK (0.48) LCKALDH1A1TDP1MAPTKDM4E
Boric Acid SCHEMBL28584646 0.93 LCK (0.45) LCKALDH1A1TDP1
SCHEMBL3429422 0.91 LCK (0.54) LCKALDH1A1TDP1
Sulfuric Acid SCHEMBL10825745 0.89 LCK (0.42) LCKALDH1A1NPC1L3MBTL1
SCHEMBL14228511 0.89 LCK (0.69) LCKLOXLOXL3LOXL2
SCHEMBL18392085 0.85 CYP1A2 (0.45) LCKALDH1A1TDP1MAPTTSHR
SCHEMBL65032 0.85 LCK (0.62) LCKALDH1A1TDP1NPC1L3MBTL1
SCHEMBL3429419 0.85 LCK (0.48) LCK
SCHEMBL63923 0.84 LCK (0.58) LCKALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
US-12032287-B2 Resist material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-07-09 US disclosed
US-11994798-B2 Resist material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-05-28 US disclosed
WO-2023142167-A1 CATIONIC LIPID ANALOG, AND COMPOSITION AND USE THEREOF 广州立得生物医药科技有限公司 2023-08-03 WO disclosed
US-20210063871-A1 RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-03-04 US disclosed
US-20210063873-A1 RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-03-04 US disclosed
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 disclosed
EP-1094058-A1 Selective reductive amination of nitriles AIR PRODUCTS AND CHEMICALS, INC. (US) 2001-04-25 EP disclosed
EP-0913388-A1 Hydrogenation of nitriles to produce amines AIR PRODUCTS AND CHEMICALS, INC. (US) 1999-05-06 EP disclosed
US-5869653-A USING SPONGE OR RANEY COBALT CATALYST; AMMONIA-FREE REACTION AIR PRODUCTS AND CHEMICALS, INC. (US) 1999-02-09 US disclosed
US-4115634-A URETHANE BY POLYMERIZING POLYISOCYANATE AND COMPOUND WITH ACTIVE HYDROGEN, ORGANOMETALLIC CATALYST AIR PRODUCTS & CHEMICALS, INC. (US) 1978-09-19 US disclosed