SCHEMBL1361936

SCHEMBL1361936

OC1CCCCC1NCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.58
FUCA1 P04066 1/20 0.51
KDM1A O60341 1/20 0.50
MAOA P21397 1/20 0.50
CD274 Q9NZQ7 1/20 0.46
GRIN2B Q13224 1/20 0.46
SLC18A3 Q16572 1/20 0.45
TRPV3 Q8NET8 5/20 0.45
EPHX1 P07099 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL15780394 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
SCHEMBL28709021 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
SCHEMBL15921601 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
SCHEMBL697762 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
SCHEMBL1755583 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
SCHEMBL14001426 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
SCHEMBL697761 1.00 LTA4H (0.58) LTA4HFUCA1KDM1AMAOACD274
Hydrochloric Acid SCHEMBL3337665 0.98 LTA4H (0.56) LTA4HFUCA1KDM1AMAOACD274
Hydrochloric Acid SCHEMBL3337659 0.98 LTA4H (0.56) LTA4HFUCA1KDM1AMAOACD274
Hydrochloric Acid SCHEMBL3337663 0.98 LTA4H (0.56) LTA4HFUCA1KDM1AMAOACD274

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315609-B Technological method for preparing cis-2-aminocyclohexanol 大连双硼医药化工有限公司 2024-01-30 CN disclosed
CN-114315609-A Process for preparing cis-2-aminocyclohexanol 大连双硼医药化工有限公司 2022-04-12 CN disclosed
EP-2951180-B1 2,6,7,8 SUBSTITUTED PURINES AS HDM2 INHIBITORS MERCK SHARP & DOHME (US) 2018-05-02 EP disclosed
CN-107011190-A A kind of 1,2 7-oxa-bicyclo[4.1.0 open loop prepares the new technology of β aminocyclohexanols 湖南理工学院 2017-08-04 CN disclosed
CN-106477655-A A kind of industrial sewage treating agent 郑州天舜电子技术有限公司 2017-03-08 CN disclosed
US-9586899-B2 Synthetic process for aminocyclohexyl ether compounds CARDIOME PHARMA CORP. (CA) 2017-03-07 US disclosed
US-9586899-B2 Synthetic process for aminocyclohexyl ether compounds CARDIOME PHARMA CORP. (CA) 2017-03-07 US disclosed
US-9540377-B2 2,6,7,8 substituted purines as HDM2 inhibitors MERCK SHARP & DOHME CORP. (US) 2017-01-10 US disclosed
US-20160009694-A1 CYCLOHEXANEDIAMINE COMPOUNDS AND METHODS FOR THEIR PREPARATION ALEXION PHARMACEUTICALS, INC. 2016-01-14 US disclosed
US-20160009694-A1 CYCLOHEXANEDIAMINE COMPOUNDS AND METHODS FOR THEIR PREPARATION ALEXION PHARMACEUTICALS, INC. 2016-01-14 US disclosed
EP-1461315-B1 CATALYTIC CARBONYLATION OF THREE AND FOUR MEMBERED HETEROCYCLES CORNELL RES FOUNDATION INC (US) 2009-07-29 EP disclosed
EP-1828099-A1 SYNTHETIC PROCESS FOR AMINOCYCLOHEXYL ETHER COMPOUNDS Cardimone Pharma Corporation (CA) 2007-09-05 EP disclosed
WO-2007055180-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE TRANS-2-AMINOCYCLOHEXANOL AND DERIVATIVE THEREOF TORAY FINE CHEMICALS CO., LTD. (JP) 2007-05-18 WO disclosed
WO-2006088525-A1 SYNTHETIC PROCESS FOR AMINOCYCLOHEXYL ETHER COMPOUNDS CARDIOME PHARMA CORP. (CA) 2006-08-24 WO disclosed
EP-1461315-A4 CATALYTIC CARBONYLATION OF THREE AND FOUR MEMBERED HETEROCYCLES CORNELL RES FOUNDATION INC (US) 2005-06-01 EP disclosed
US-6852865-B2 Catalytic carbonylation of three and four membered heterocycles CORNELL RESEARCH FOUNDATION, INC. (US) 2005-02-08 US disclosed
EP-1461315-A2 CATALYTIC CARBONYLATION OF THREE AND FOUR MEMBERED HETEROCYCLES CORNELL RESEARCH FOUNDATION, INC. (US) 2004-09-29 EP disclosed
US-20040029875-A1 Novel aminotriazolone compounds, method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2004-02-12 US disclosed
US-20030162961-A1 Catalytic carbonylation of three and four membered heterocycles CORNELL RESEARCH FOUNDATION, INC. 2003-08-28 US disclosed
WO-2003050154-A2 CATALYTIC CARBONYLATION OF THREE AND FOUR MEMBERED HETEROCYCLES CORNELL RESEARCH FOUNDATION, INC. (US) 2003-06-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160009694-A1 CYCLOHEXANEDIAMINE COMPOUNDS AND METHODS FOR THEIR PREPARATION SYK, BTK, LCK LTA4H 968/4885FUCA1 1168/4885KDM1A 712/4885
US-20040029875-A1 Novel aminotriazolone compounds, method for preparing same and pharmaceutical compositions containing same ADORA1, AASDHPPT, AADAT LTA4H 649/4885FUCA1 3143/4885KDM1A 2252/4885
US-20030162961-A1 Catalytic carbonylation of three and four membered heterocycles LOX, CA9, LPO LTA4H 90/4885FUCA1 3834/4885KDM1A 247/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.