SCHEMBL5839696

SCHEMBL5839696

NCCCCCCN1CCCCCC1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.75
SMN1; SMN2 Q16637 2/20 0.48
KEAP1 Q14145 1/20 0.48
SIGMAR1 Q99720 3/20 0.47
MAPT P10636 1/20 0.46
CYP1A2 P05177 1/20 0.45
MAPK1 P28482 1/20 0.45
ALOX15 P16050 1/20 0.43

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
SCHEMBL21799578 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL8553937 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL9322416 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL491616 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL7230416 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL491983 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL21799504 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL21799790 1.00 HRH3 (0.75) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
SCHEMBL10480715 0.98 HRH3 (0.71) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT
Hydrazine SCHEMBL8558416 0.98 HRH3 (0.71) HRH3SMN1; SMN2KEAP1SIGMAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6252115-B1 ADDING TO THE DISTILLATION MIXTURE AN INERT COMPOUND HAVING A BOILING POINT HIGHER THAN THE AMINE BASF AKTIENGESELLSCHAFT (DE) 2001-06-26 US claimed
EP-0964847-A1 METHOD FOR SEPARATING AN IMINE FROM A MIXTURE CONTAINING AN AMINE AND AN IMINE BASF AKTIENGESELLSCHAFT (DE) 1999-12-22 EP claimed
WO-1998034900-A1 METHOD FOR SEPARATING AN IMINE FROM A MIXTURE CONTAINING AN AMINE AND AN IMINE BASF AKTIENGESELLSCHAFT (DE) 1998-08-13 WO claimed
US-5216152-A To yield hexamethyleneimine, hexamethylenediamine, and n-/6-aminohexyl/hexamethyleneimine E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-06-01 US claimed
EP-4613735-A1 METHOD FOR PREPARING HEXAMETHYLENEDIAMINE CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2025-09-10 EP disclosed
CN-118477638-A Supported Ru-based catalyst, preparation method thereof and application thereof in preparation of hexamethylenediamine by amination of cyclohexylimine 开滦(集团)有限责任公司 2024-08-13 CN disclosed
US-20230390747-A1 AMINATION CATALYST AND PREPARATION AND USE THEREOF BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY (CN) 2023-12-07 US disclosed
US-20230381757-A1 AMINATION CATALYST AND PREPARATION AND USE THEREOF BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY (CN) 2023-11-30 US disclosed
EP-4238648-A1 AMINATION CATALYST AND PREPARATION AND USE THEREOF China Petroleum & Chemical Corporation (CN) 2023-09-06 EP disclosed
EP-4238647-A1 AMINATION CATALYST AND PREPARATION AND USE THEREOF China Petroleum & Chemical Corporation (CN) 2023-09-06 EP disclosed
CN-112898163-B Method for preparing 1, 6-hexamethylene diamine by ammoniation of hexamethylene imine 中国科学院大连化学物理研究所 2022-06-24 CN disclosed
CN-112898164-B Method for preparing 1, 6-hexamethylene diamine from 5-hydroxymethylfurfural 中国科学院大连化学物理研究所 2022-03-04 CN disclosed
US-5288911-A Catalytic reaction of alkandiols with ammonia BASF AKTIENGESELLSCHAFT (DE) 1994-02-22 US disclosed
US-5216149-A Sequential pyrolysis using different temperatures, catalysts and supports to provide selective recovery of desired product MIDWEST RESEARCH INSTITUTE (US) 1993-06-01 US disclosed
US-5216152-A To yield hexamethyleneimine, hexamethylenediamine, and n-/6-aminohexyl/hexamethyleneimine E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-06-01 US disclosed
US-5216152-A To yield hexamethyleneimine, hexamethylenediamine, and n-/6-aminohexyl/hexamethyleneimine E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-06-01 US disclosed
WO-1992022528-A2 CONTROLLED CATALYTIC AND THERMAL SEQUENTIAL PYROLYSIS AND HYDROLYSIS OF MIXED POLYMER WASTE STREAMS TO SEQUENTIALLY RECOVER MONOMERS OR OTHER HIGH VALUE PRODUCTS MIDWEST RESEARCH INSTITUTE (US) 1992-12-23 WO disclosed
EP-0510382-A2 Method of preparation of alpha-omega-aminoalcohols BASF Aktiengesellschaft (DE) 1992-10-28 EP disclosed
US-4290946-A CONTINUOUS PROCESSING, HEXAMETHYLENEDIAMINE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-09-22 US disclosed
US-4014933-A Production of amines from alcohols BASF AKTIENGESELLSCHAFT (DT) 1977-03-29 US disclosed