SCHEMBL5139380

SCHEMBL5139380

C=CCC(=O)NCCCCC

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.58
ZDHHC2 Q9UIJ5 1/20 0.58
CASP2 P42575 1/20 0.57
NAAA Q02083 1/20 0.53
EPHX1 P07099 6/20 0.52
FAAH O00519 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
EPHX2 P34913 2/20 0.46

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
SCHEMBL4649336 0.94 ZDHHC20 (0.50) ZDHHC20ZDHHC2CASP2NAAAEPHX1
SCHEMBL26253129 0.88 MEN1 (0.68) ZDHHC20ZDHHC2CASP2NAAAEPHX1
SCHEMBL11528071 0.85
SCHEMBL26253127 0.84 MEN1 (0.61) ZDHHC20ZDHHC2CASP2FAAHMEN1
SCHEMBL6531858 0.82 SMN1; SMN2 (0.41) ZDHHC20ZDHHC2CASP2NAAAFAAH
SCHEMBL22104112 0.82 CASP2 (0.59) ZDHHC20ZDHHC2CASP2NAAAEPHX1
SCHEMBL10337028 0.80 NQO2 (0.42) FAAHMEN1KMT2A
SCHEMBL1077291 0.79 ZDHHC20 (0.53) ZDHHC20ZDHHC2CASP2NAAAEPHX1
SCHEMBL15223337 0.79 PAOX (0.44) ZDHHC20ZDHHC2CASP2NAAAFAAH
SCHEMBL17743162 0.79 TSHR (0.55) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006086609-A2 INHIBITORS OF TRYPTASE AXYS PHARMACEUTICALS, INC. (US) 2006-08-17 WO claimed
US-6376429-B1 CONTROLLING WEEDS HOECHST SCHERING AGREVO GMBH (DE) 2002-04-23 US claimed
US-6297196-B1 HETEROCYCLIC COMPOUNDS WITH KETONE GROUPS AND OXIMES, PHOSPHONATES OR PHOSPHATES HOECHST SCHERING AGREVO GMBH (DE) 2001-10-02 US claimed
EP-1117639-A1 BENZOYLCYCLOHEXANDIONES, METHOD FOR THE PRODUCTION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS Aventis CropScience GmbH (DE) 2001-07-25 EP claimed
EP-1109807-A1 BENZOYL DERIVATIVES, METHOD FOR PRODUCING THEM AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS Aventis CropScience GmbH (DE) 2001-06-27 EP claimed
US-6211216-B1 KETONES AS HERBICIDES AVENTIS CORPSCIENCE GMBH (DE) 2001-04-03 US claimed
WO-2000021924-A1 BENZOYLCYCLOHEXANDIONES, METHOD FOR THE PRODUCTION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2000-04-20 WO claimed
WO-2000014087-A1 BENZOYL DERIVATIVES, METHOD FOR PRODUCING THEM AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2000-03-16 WO claimed
WO-1998006710-A1 SUBSTITUTED 4-NITROIMINO-PERHYDRO-1,3,5-OXADIAZINE DERIVATIVES, THEIR USE AS PESTICIDES AND INTERMEDIATES FOR THEIR PREPARATION NOVARTIS AG (CH) 1998-02-19 WO claimed
CN-104508563-B Pattern forming method and the electronic device manufacturing method and electronic device for respectively using it 富士胶片株式会社 2019-05-28 CN disclosed
EP-2994156-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASES THROUGH INHIBITING TGF- ACTIVITY Southern Research Institute (US) 2016-03-16 EP disclosed
WO-2014183018-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASES THROUGH INHIBITING TGF-β ACTIVITY SOUTHERN RESEARCH INSTITUTE (US) 2014-11-13 WO disclosed
US-8273740-B2 antiallergen; not direct way to change nature of immunological response to allergen; G-protein-coupled \"chemoattractant receptor-homologous molecule expressed on Th2 cells (CRTH2)\" antagonist for prostaglandin PGD2, that mediates PGD2-dependent migration of blood Th2 cells; ; asthma, rhinitis, COPD ACTELION PHARMACEUTICALS, LTD. (CH) 2012-09-25 US disclosed
US-20080108638-A1 2-Sulfanyl-Benzoimidazol-1-Yl-Acetic Acid Derivatives as Crth2 Antagonists ACTELION PHARMACEUTICALS,LTD. (CH) 2008-05-08 US disclosed
EP-1109807-A1 BENZOYL DERIVATIVES, METHOD FOR PRODUCING THEM AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS Aventis CropScience GmbH (DE) 2001-06-27 EP disclosed
US-6211216-B1 KETONES AS HERBICIDES AVENTIS CORPSCIENCE GMBH (DE) 2001-04-03 US disclosed
WO-2001007422-A1 ISOXAZOLYL- AND ISOXAZOLINYL-SUBSTITUTED BENZOYLCYCLOHEXANEDIONES, PRODUCTION METHOD AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2001-02-01 WO disclosed
WO-2000021924-A1 BENZOYLCYCLOHEXANDIONES, METHOD FOR THE PRODUCTION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2000-04-20 WO disclosed
WO-2000014087-A1 BENZOYL DERIVATIVES, METHOD FOR PRODUCING THEM AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2000-03-16 WO disclosed
WO-1998006710-A1 SUBSTITUTED 4-NITROIMINO-PERHYDRO-1,3,5-OXADIAZINE DERIVATIVES, THEIR USE AS PESTICIDES AND INTERMEDIATES FOR THEIR PREPARATION NOVARTIS AG (CH) 1998-02-19 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 (1 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-20080108638-A1 2-Sulfanyl-Benzoimidazol-1-Yl-Acetic Acid Derivatives as Crth2 Antagonists HRH2, HRH1, HRH3 ZDHHC20 747/4885ZDHHC2 239/4885CASP2 3087/4885

“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.