SCHEMBL5701247

SCHEMBL5701247

ClCCOc1ccc2ccccc2c1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.68
KDM4E B2RXH2 2/20 0.68
MAPK1 P28482 1/20 0.68
AGXT P21549 2/20 0.59
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
MAPT P10636 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ALOX5 P09917 1/20 0.55
PPARG P37231 2/20 0.53
PTPN7 P35236 1/20 0.52
HTT P42858 1/20 0.51
HRH3 Q9Y5N1 5/20 0.50
DRD3 P35462 1/20 0.50
ALDH1A1 P00352 1/20 0.50
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
HDAC1 Q13547 1/20 0.49

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
SCHEMBL31570764 1.00 TDP1 (0.68) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL5701220 0.92 TDP1 (0.68) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL38652291 0.90 TDP1 (0.66) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL5701129 0.90 TDP1 (0.66) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL20110893 0.89 TDP1 (0.82) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL10526722 0.88 TDP1 (0.63) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL16902851 0.87 TDP1 (0.87) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL29429997 0.85 TDP1 (0.76) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL8565990 0.85 TDP1 (0.76) TDP1KDM4EMAPK1AGXTNPC1
SCHEMBL1859481 0.85 TDP1 (0.76) TDP1KDM4EMAPK1AGXTNPC1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3717466-A1 COMPOUNDS FOR SEPARATION OF RARE EARTH ELEMENTS AND S-, P-, D- METALS, METHOD OF SEPARATION, AND USE THEREOF Ustav Organicke Chemie a Biochemie AV CR, v.v.i. (CZ) 2020-10-07 EP disclosed
US-20180118671-A1 BETA-NAPHTHOL ETHER SULFONATES, PROCESSES FOR PREPARING THEM AND USE THEREOF AS BRIGHTNESS IMPROVERS BASF SE (DE) 2018-05-03 US disclosed
CN-106748825-A A kind of synthesis of Dapoxetine hydrochloride, resolving and purifying and salifying method 聊城大学 2017-05-31 CN disclosed
CN-101367739-B Preparation of N,N-dimethyl-1-phenyl-3-(1-naphthoxy) propanamine TAIZHOU VOCATIONAL & TECHNICAL COLLEGE 2013-02-13 CN disclosed
CN-101367739-A Preparation of N,N-dimethyl-1-phenyl-3-(1-naphthoxy) propanamine TAIZHOU VOCATIONAL & TECHNICAL (CN) 2009-02-18 CN disclosed
CN-100447126-C Omega substituted naphthyloxy-amino alkane den-ivative used as anti-hyperglycaemia agent and its preparation therefor COUNCIL SCIENT IND RES (IN) 2008-12-31 CN disclosed
CN-1894200-A Omega-substituted naphthyloxy amino alkane derivatives as antihyperglycemic agents and preparation thereof COUNCIL SCIENT IND RES (IN) 2007-01-10 CN disclosed
EP-1682484-A1 OMEGA-SUBSTITUTED-NAPHTHYLOXYALKLAMINO DERIVATIVES AS ANTIHYPERGLYCEMIC AGENTS AND PREPARATION COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-07-26 EP disclosed
US-7081465-B2 Alpha-substituted naphthyloxy omega-substituted alky/aryl amino-substituted alkane derivatives as agent for treatment or prophylaxis of diabetes and related metabolic disorders COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-07-25 US disclosed
WO-2005042465-A1 OMEGA-SUBSTITUTED-NAPHTHYLOXYALKLAMINO DERIVATIVES AS ANTIHYPERGLYCEMIC AGENTS AND PREPARATION COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2005-05-12 WO disclosed
US-20040192688-A1 Alpha-substituted naphthyloxy omega-substituted alkyl/aryl amino-substituted alkane derivatives as agent for treatment or prophylaxis of diabetes and related metabolic disorders COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH 2004-09-30 US disclosed
EP-1175400-A1 RENIN INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-30 EP disclosed
WO-2000064873-A1 RENIN INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2000-11-02 WO disclosed
US-4053621-A 1-[2-(βNaphthyloxy)ethyl]-3-methylpyrazolone-(5) and antithrombotic and antithrombolytic compositions and methods utilizing them BAYER AKTIENGESELLSCHAFT (DT) 1977-10-11 US 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 (2 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-20180118671-A1 BETA-NAPHTHOL ETHER SULFONATES, PROCESSES FOR PREPARING THEM AND USE THEREOF AS BRIGHTNESS IMPROVERS LBR, IK, NES TDP1 3855/4885KDM4E 4380/4885MAPK1 1775/4885
US-20040192688-A1 Alpha-substituted naphthyloxy omega-substituted alkyl/aryl amino-substituted alkane derivatives as agent for treatment or prophylaxis of diabetes and related metabolic disorders APOB, LIPC, FABP3 TDP1 2757/4885KDM4E 2830/4885MAPK1 3030/4885

“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.