SCHEMBL4294178

SCHEMBL4294178

CCC(Cl)N1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.35
SLC6A4 P31645 6/20 0.35
SLC6A2 P23975 6/20 0.35
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
FDPS P14324 2/20 0.31

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
Hydrochloric Acid SCHEMBL1622048 0.97 SLC6A4 (0.34) SLC6A3SLC6A4SLC6A2ALDH1A1MAPT
SCHEMBL4691097 0.97
Hydrochloric Acid SCHEMBL4931478 0.95 SLC6A3 (0.35) SLC6A3SLC6A4SLC6A2
SCHEMBL27128838 0.92
SCHEMBL28790729 0.77
SCHEMBL9114190 0.77 CHRM2 (0.34) SLC6A3SLC6A4SLC6A2
SCHEMBL5605219 0.77 OPRD1 (0.37) SLC6A3SLC6A4SLC6A2
SCHEMBL28205449 0.77 SLC6A3 (0.37) SLC6A3SLC6A4SLC6A2
SCHEMBL10499146 0.77 HRH3 (0.42) SLC6A3SLC6A4SLC6A2ALDH1A1MAPT
SCHEMBL4807714 0.76 FDPS (0.32) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0237411-A1 (Piperidino-3)propoxy-5p-cymene, its acetyl, acetoxy and hydroxy derivatives, salts of these products, process for the preparation of these compounds and medicines containing at least one of these products as active principle INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (I.R.C.E.B.A.) Société à responsabilité limitée dite: (FR) 1987-09-16 EP claimed
CN-109776551-A Dioxanes and quinazoline derivant preparation method 北京工业大学 2019-05-21 CN disclosed
CN-108467372-A The preparation method of difenidol hydrochloride 江苏四环生物制药有限公司 2018-08-31 CN disclosed
CN-108467372-A The preparation method of difenidol hydrochloride 江苏四环生物制药有限公司 2018-08-31 CN disclosed
US-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2017-06-29 US disclosed
US-9532983-B2 Benzofuran compounds, compositions, kits and/or methods thereof SAVANNAH STATE UNIVERSITY (US) 2017-01-03 US disclosed
US-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2015-05-14 US disclosed
EP-2474533-B1 PREPARATION OF 1-(SUBSTITUTED BENZYL)-5-TRIFLUOROMETHYL-2-(1H)PYRIDONE COMPOUNDS AND SALTS THEREOF AND THEIR APPLICATIONS UNIV CENTRAL SOUTH (CN) 2015-02-25 EP disclosed
EP-2436670-B1 Preparation of 1-(substituted aryl)-5-trifluoromethyl-2-(1H)pyridone compounds and salts thereof and their applications UNIV CENTRAL SOUTH (CN) 2014-04-16 EP disclosed
CN-102149683-B 1- (substituted benzyl) -5-trifluoromethyl-2- (1H) pyridone compound and salt thereof, and preparation method and application thereof UNIV CENTRAL SOUTH 2013-10-02 CN disclosed
US-20010051632-A1 Phenyl-substituted indolizines and tetrahydroindolizines ORTHO MCNEIL PHARMACEUTICAL, INC. 2001-12-13 US disclosed
WO-2001074814-A1 PHENYL-SUBSTITUTED INDOLIZINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 LIGANDS ORTHO MCNEIL PHARMACEUTICAL, INC. (US) 2001-10-11 WO disclosed
EP-0801649-A2 HYDROXYLAMINE DERIVATIVES USEFUL FOR ENHANCING THE MOLECULAR CHAPERON PRODUCTION AND THE PREPARATION THEREOF BIOREX KUTATO ES FEJLESZTÖ RT. (HU) 1997-10-22 EP disclosed
WO-1997016439-A1 HYDROXYLAMINE DERIVATIVES USEFUL FOR ENHANCING THE MOLECULAR CHAPERON PRODUCTION AND THE PREPARATION THEREOF Biorex Kutató és Fejlesztó Rt. (HU) 1997-05-09 WO disclosed
EP-0237411-A1 (Piperidino-3)propoxy-5p-cymene, its acetyl, acetoxy and hydroxy derivatives, salts of these products, process for the preparation of these compounds and medicines containing at least one of these products as active principle INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (I.R.C.E.B.A.) Société à responsabilité limitée dite: (FR) 1987-09-16 EP disclosed
EP-0076756-B1 PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THERAPEUTICAL COMPOSITIONS CONTAINING THEM ETABLISSEMENTS NATIVELLE S.A. (FR) 1987-03-04 EP disclosed
EP-0037344-B1 AMINO-ALCOXY PYRAZOLES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM ETABLISSEMENTS NATIVELLE S.A. (FR) 1984-07-11 EP disclosed
EP-0076756-A1 Pyrazole derivatives, process for their preparation, and therapeutical compositions containing them ETABLISSEMENTS NATIVELLE S.A. (FR) 1983-04-13 EP disclosed
US-4330544-A Amino-alkoxy pyrazoles and pharmaceutical compositions ETABLISSEMENTS NATIVELLE S.A. (FR) 1982-05-18 US disclosed
EP-0037344-A1 Amino-alcoxy pyrazoles, process for their preparation and medicaments containing them ETABLISSEMENTS NATIVELLE S.A. (FR) 1981-10-07 EP 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-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SIGMAR1, OPRM1, OPRL1 SLC6A3 797/4885SLC6A4 430/4885SLC6A2 568/4885
US-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SIGMAR1, OPRM1, OPRL1 SLC6A3 797/4885SLC6A4 430/4885SLC6A2 568/4885
US-20010051632-A1 Phenyl-substituted indolizines and tetrahydroindolizines TPH2, TPH1, IDO2 SLC6A3 64/4885SLC6A4 28/4885SLC6A2 54/4885

“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.