SCHEMBL1661296

SCHEMBL1661296

COc1cc(COCCCCOCCCCOCc2ccc(O)c(OC)c2)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.57
TAAR1 Q96RJ0 2/20 0.56
TSHR P16473 2/20 0.56
MAPK1 P28482 1/20 0.56
FOS P01100 1/20 0.54
TTR P02766 1/20 0.54
JUN P05412 1/20 0.54
NR3C1 P04150 1/20 0.54
HSD17B1 P14061 1/20 0.54
HSD17B2 P37059 1/20 0.54
LMNA P02545 1/20 0.54
GLA P06280 1/20 0.54
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 2/20 0.53
ALOX5 P09917 2/20 0.53
GAA P10253 1/20 0.53
NFKB1 P19838 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
AR P10275 1/20 0.53
PTGS1 P23219 1/20 0.53

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
SCHEMBL22616307 0.97 PTPN1 (0.57) PTPN1TAAR1TSHRMAPK1FOS
SCHEMBL119627 0.92 CYP1A2 (0.56) PTPN1ALDH1A1CYP3A4ALOX15
SCHEMBL28304313 0.92 PTPN1 (0.53) PTPN1TAAR1TSHRMAPK1FOS
SCHEMBL29873001 0.92 CYP1A2 (0.56) PTPN1ALDH1A1CYP3A4ALOX15
SCHEMBL29873336 0.91 CYP1A2 (0.58) ALDH1A1CYP3A4ALOX15
SCHEMBL117978 0.91 CYP1A2 (0.58) ALDH1A1CYP3A4ALOX15
SCHEMBL14763888 0.90 PTPN1 (0.54) PTPN1TAAR1TSHRMAPK1FOS
SCHEMBL29602123 0.90 PTPN1 (0.54) PTPN1TAAR1TSHRMAPK1FOS
SCHEMBL117401 0.90 PTPN1 (0.54) PTPN1TAAR1TSHRMAPK1FOS
SCHEMBL27976302 0.90 ALDH1A1 (0.54) PTPN1TAAR1TSHRMAPK1FOS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6306429-B1 THROAT DROPS SUITABLE FOR RELIEF OF COUGH AND COLD SYMPTOMS THE PROCTER & GAMBLE COMPANY 2001-10-23 US claimed
US-20240000746-A1 New Cooling Agents and Preparations Containing Them SYMRISE AG (DE) 2024-01-04 US disclosed
US-9446267-B2 Products comprising a flavoring agent composition SYMRISE AG (DE) 2016-09-20 US disclosed
US-8496950-B2 Mixture containing menthol SYMRISE AG (DE) 2013-07-30 US disclosed
US-8242289-B2 Alkyl-substituted tetrahydropyrans as flavoring substances SYMRISE AG (DE) 2012-08-14 US disclosed
US-20120128744-A1 MIXTURE CONTAINING MENTHOL SYMRISE AG (DE) 2012-05-24 US disclosed
US-20110081303-A1 TEETH CLEANING COMPOUND CONTAINING MENTHOL WITH REDUCED BITTER SENSATION SYMRISE AG (DE) 2011-04-07 US disclosed
US-20100226864-A1 ALKYL-SUBSTITUTED TETRAHYDROPYRANS AS FLAVORING SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2010-09-09 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 (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-20100226864-A1 ALKYL-SUBSTITUTED TETRAHYDROPYRANS AS FLAVORING SUBSTANCES TAS1R3, TAS2R10, TAS2R50 PTPN1 2991/4885TAAR1 42/4885TSHR 2939/4885
US-20240000746-A1 New Cooling Agents and Preparations Containing Them TTPA, TREH, TAS2R45 PTPN1 3398/4885TAAR1 2536/4885TSHR 1885/4885
US-20110081303-A1 TEETH CLEANING COMPOUND CONTAINING MENTHOL WITH REDUCED BITTER SENSATION TAS2R10, TAS2R30, TAS2R14 PTPN1 4618/4885TAAR1 152/4885TSHR 3973/4885

“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.