SCHEMBL681333

SCHEMBL681333

CNCCc1cc(OC)ccc1OC

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.64
TAAR1 Q96RJ0 1/20 0.64
MTNR1A P48039 1/20 0.57
MTNR1B P49286 1/20 0.57
HTR2A P28223 4/20 0.57
HTR2C P28335 1/20 0.57
AOC3 Q16853 1/20 0.57
IDO1 P14902 2/20 0.54
POLB P06746 1/20 0.54
ATM Q13315 1/20 0.54
CHRM2 P08172 1/20 0.53
CHRM1 P11229 1/20 0.53
CHRM3 P20309 1/20 0.53
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL932357 0.86 APLNR (0.61) HTR2AHTR2CPOLBATMCHRM2
SCHEMBL5267466 0.84 ADRA1A (0.62) ADRA1ATAAR1MTNR1AMTNR1BHTR2A
Hydrochloric Acid SCHEMBL28901936 0.84 APLNR (0.59) HTR2AHTR2CPOLBATMCHRM2
SCHEMBL1254174 0.81 HTR2A (0.65) ADRA1ATAAR1HTR2AHTR2CIDO1
SCHEMBL20153915 0.81 ADRA1A (0.58) ADRA1ATAAR1MTNR1AMTNR1BHTR2A
SCHEMBL8230324 0.81 HTR2A (0.54) ADRA1ATAAR1MTNR1AMTNR1BHTR2A
SCHEMBL8124998 0.81 HTR2A (0.63) TAAR1HTR2AHTR2CPOLBATM
SCHEMBL5252421 0.81 IDO1 (0.66) ADRA1ATAAR1MTNR1AMTNR1BHTR2A
SCHEMBL6506680 0.80 ADRA1A (0.57) ADRA1ATAAR1MTNR1AMTNR1BHTR2A
SCHEMBL5154843 0.79 ADRA1A (0.70) ADRA1ATAAR1MTNR1AMTNR1BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2835648-B1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families RANDOX LABORATORIES LTD (GB) 2018-12-12 EP claimed
EP-2835648-A1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families Randox Laboratories Ltd. (GB) 2015-02-11 EP claimed
US-20150038366-A1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families NORTHERN BANK LIMITED (IE) 2015-02-05 US claimed
EP-3256470-B1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA FARBER CANCER INST INC (US) 2023-07-26 EP disclosed
US-10775394-B2 Immunoassay for phenethylamines of the 2C and DO sub-families RANDOX LABORATORIES LIMITED (GB) 2020-09-15 US disclosed
EP-2835648-B1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families RANDOX LABORATORIES LTD (GB) 2018-12-12 EP disclosed
US-20180209998-A1 IMMUNOASSAY FOR PHENETHYLAMINES OF THE 2C AND DO SUB-FAMILIES RANDOX LABORATORIES LIMITED 2018-07-26 US disclosed
US-9945877-B2 Immunoassay for phenethylamines of the 2C and DO sub-families RANDOX LABORATORIES LIMITED (GB) 2018-04-17 US disclosed
EP-2835648-A1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families Randox Laboratories Ltd. (GB) 2015-02-11 EP disclosed
US-20150038366-A1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families NORTHERN BANK LIMITED (IE) 2015-02-05 US disclosed
US-20130122050-A1 COMPOSITIONS AND METHODS FOR TREATING DIABETES USING LISOFYLLINE ANALOGS AND ISLET NEOGENESIS ASSOCIATED PEPTIDE DIAKINE THERAPEUTICS, INC. (US) 2013-05-16 US disclosed
WO-2009099582-A2 COMPOSITIONS AND METHODS FOR TREATING DIABETES USING LISOFYLLINE ANALOGS AND ISLET NEOGENESIS ASSOCIATED PEPTIDE DIAKINE THERAPEUTICS, INC. (US) 2009-08-13 WO disclosed
US-20080300189-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING BETA-CELL MASS AND FUNCTION DIAKINE THERAPEUTICS, INC. (US) 2008-12-04 US disclosed
US-20080300189-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING BETA-CELL MASS AND FUNCTION DIAKINE THERAPEUTICS, INC. (US) 2008-12-04 US disclosed
US-7393827-B2 Pharmaceutical compositions and methods for restoring β-cell mass and function DIAKINE THERAPEUTICS, INC. (US) 2008-07-01 US disclosed
US-7393827-B2 Pharmaceutical compositions and methods for restoring β-cell mass and function DIAKINE THERAPEUTICS, INC. (US) 2008-07-01 US disclosed
WO-2008011518-A2 ENCAPSULATION SYSTEM DIAKINE THERAPEUTICS, INC. (US) 2008-01-24 WO disclosed
WO-2007146786-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING B-CELL MASS AND FUNCTION DIAKINE THERAPEUTICS, INC. (US) 2007-12-21 WO disclosed
EP-1757591-A1 CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2007-02-28 EP disclosed
WO-2006074051-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING β-CELL MASS AND FUNCTION DIAKINE THERAPEUTICS, INC. (US) 2006-07-13 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 (5 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-10775394-B2 Immunoassay for phenethylamines of the 2C and DO sub-families PNMT, DDT, COMT ADRA1A 565/4885TAAR1 514/4885MTNR1A 839/4885
US-20130122050-A1 COMPOSITIONS AND METHODS FOR TREATING DIABETES USING LISOFYLLINE ANALOGS AND ISLET NEOGENESIS ASSOCIATED PEPTIDE IAPP, LITAF, IGF2BP1 ADRA1A 3488/4885TAAR1 4461/4885MTNR1A 230/4885
US-20180209998-A1 IMMUNOASSAY FOR PHENETHYLAMINES OF THE 2C AND DO SUB-FAMILIES PNMT, DDT, COMT ADRA1A 565/4885TAAR1 514/4885MTNR1A 839/4885
US-20150038366-A1 Immunoassay for Phenethylamines of the 2C and DO Sub-Families PNMT, DDT, COMT ADRA1A 565/4885TAAR1 514/4885MTNR1A 839/4885
US-20080300189-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR RESTORING BETA-CELL MASS AND FUNCTION IAPP, PNLIP, AMY2A ADRA1A 268/4885TAAR1 4140/4885MTNR1A 934/4885

“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.