SCHEMBL13380958

SCHEMBL13380958

CC1COC(c2ccco2)O1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
APOBEC3A P31941 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
ALDH1A1 P00352 5/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CHRM5 P08912 10/20 0.38
CHRM3 P20309 10/20 0.38
CHRM2 P08172 9/20 0.38
CHRM4 P08173 9/20 0.38
CHRM1 P11229 9/20 0.38
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.36
TBXAS1 P24557 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL14272693 1.00 POLB (0.51) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL13380972 0.81 POLB (0.47) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL13381127 0.77 POLB (0.62) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL13381164 0.77 POLB (0.48) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL13381220 0.75 POLB (0.59) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL18963354 0.74 ALDH1A1 (0.43) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL11457323 0.74 POLB (0.58) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL10000234 0.74 POLB (0.58) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL10000236 0.73 POLB (0.43) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1
SCHEMBL13381222 0.73 POLB (0.47) POLBAPOBEC3ACTDSP1APOBEC3GALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649183-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP claimed
EP-3649184-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP claimed
US-20190010427-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US claimed
US-20190010293-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US claimed
WO-2019010265-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2019-01-10 WO claimed
WO-2019010263-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2019-01-10 WO claimed
WO-2017046059-A1 PERFUME COMPOSITION HAVING SCENT MODULATOR COMPOUNDS FOR INCREASING THE FRAGRANCE INTENSITY HENKEL AG & CO. KGAA (DE) 2017-03-23 WO claimed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
US-11758933-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2023-09-19 US disclosed
EP-3368542-B1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2022-06-22 EP disclosed
US-11357246-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2022-06-14 US disclosed
US-20210227863-A1 HIGH INTENSITY SWEETENERS SENOMYX, INC. 2021-07-29 US disclosed
EP-3356356-B1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED (US) 2021-05-26 EP disclosed
WO-2017046059-A1 PERFUME COMPOSITION HAVING SCENT MODULATOR COMPOUNDS FOR INCREASING THE FRAGRANCE INTENSITY HENKEL AG & CO. KGAA (DE) 2017-03-23 WO disclosed
WO-2017046054-A1 PERFUME COMPOSITION COMPRISING AN ODOR MODULATOR COMPOUND, AMINO ALCOHOL AND ODORIFEROUS ALDEHYDE AND/OR ODORIFEROUS KETONE FOR INCREASING AND PROLONGING ODOR INTENSITY HENKEL AG & CO. KGAA (DE) 2017-03-23 WO disclosed
WO-2017046052-A1 PERFUME COMPOSITION COMPRISING FRAGRANCE MODULATOR COMPOUNDS AND SILICIC ACID ESTERS FOR INCREASING AND PROLONGING THE INTENSITY OF FRAGRANCE HENKEL AG & CO. KGAA (DE) 2017-03-23 WO disclosed
WO-2017046055-A1 PERFUME COMPOSITIONS COMPRISING MICROCAPSULES, FRAGRANCE MODULATOR COMPOUNDS AND FRAGRANCE RAW MATERIAL FOR INCREASING AND PROLONGING THE INTENSITY OF FRAGRANCE HENKEL AG & CO. KGAA (DE) 2017-03-23 WO disclosed
US-20160376263-A1 BITTER TASTE MODIFIERS INCLUDING SUBSTITUTED 1-BENZYL-3-(1-(ISOXAZOL-4-YLMETHYL)-1H-PYRAZOL-4-YL)IMIDAZOLIDINE-2,4-DIONES AND COMPOSITIONS THEREOF SENOMYX INC (US) 2016-12-29 US disclosed
US-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 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 (6 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-20240108040-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 POLB 4295/4885APOBEC3A 4477/4885CTDSP1 4529/4885
US-20160376263-A1 BITTER TASTE MODIFIERS INCLUDING SUBSTITUTED 1-BENZYL-3-(1-(ISOXAZOL-4-YLMETHYL)-1H-PYRAZOL-4-YL)IMIDAZOLIDINE-2,4-DIONES AND COMPOSITIONS THEREOF TAS2R5, TAS1R1, TAS2R1 POLB 3476/4885APOBEC3A 1197/4885CTDSP1 3345/4885
US-11357246-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 POLB 4295/4885APOBEC3A 4477/4885CTDSP1 4529/4885
US-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF NR2C2, NR4A3, NR0B2 POLB 4566/4885APOBEC3A 2940/4885CTDSP1 2879/4885
US-20210227863-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 POLB 4295/4885APOBEC3A 4477/4885CTDSP1 4529/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 POLB 4295/4885APOBEC3A 4477/4885CTDSP1 4529/4885

“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.