SCHEMBL2146116

SCHEMBL2146116

C/C=C/C=C/COC(=O)CCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
DGKA P23743 2/20 0.34
SOAT1 P35610 1/20 0.33
MGLL Q99685 1/20 0.32
NR1I2 O75469 1/20 0.32
PGR P06401 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
PTGS2 P35354 1/20 0.32
PDE4D Q08499 1/20 0.32
PAM P19021 2/20 0.32
CNR1 P21554 2/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
FASN P49327 1/20 0.31
CYP1A2 P05177 1/20 0.31
CNR2 P34972 2/20 0.30
PPARG P37231 1/20 0.30

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
SCHEMBL2146119 1.00 ALDH1A1 (0.41) ALDH1A1TSHRDGKASOAT1MGLL
SCHEMBL28249573 0.90 TSHR (0.35) ALDH1A1TSHRCNR1MAPTCNR2
SCHEMBL22581641 0.89 TSHR (0.50) ALDH1A1TSHRDGKAMGLLNR1I2
SCHEMBL2436353 0.88 ALDH1A1 (0.48) ALDH1A1TSHRDGKAMGLLNR1I2
SCHEMBL1695438 0.88 ALDH1A1 (0.48) ALDH1A1TSHRDGKAMGLLNR1I2
SCHEMBL20646268 0.86 TSHR (0.46) ALDH1A1TSHRDGKASOAT1NR1I2
SCHEMBL3789353 0.86 TSHR (0.60) ALDH1A1TSHRDGKAPAMMAPT
SCHEMBL3789355 0.86 TSHR (0.60) ALDH1A1TSHRDGKAPAMMAPT
SCHEMBL19924320 0.86 TSHR (0.60) ALDH1A1TSHRDGKAPAMMAPT
SCHEMBL3788271 0.84 TSHR (0.58) ALDH1A1TSHRDGKAPAMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240415113-A1 COMPOSITION AND METHOD FOR ATTRACTING VESPID WASPS BanfieldBio Inc. (US) 2024-12-19 US claimed
US-20240415113-A1 COMPOSITION AND METHOD FOR ATTRACTING VESPID WASPS BanfieldBio Inc. (US) 2024-12-19 US disclosed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
EP-3416729-B1 PRO-FRAGRANCE COMPOSITION AQDOT LTD (GB) 2023-09-20 EP 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
CN-108601958-B Pro-fragrance compositions 爱客多有限公司 2022-06-17 CN 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
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
US-20110165115-A1 SYNERGISTIC ATTRACTANTS FOR PESTIFEROUS SOCIAL INSECTS STERLING INTERNATIONAL INC. (US) 2011-07-07 US disclosed
US-20100248390-A1 COMPOSITIONS AND METHODS FOR IDENTIFYING LIGANDS OF ODORANT RECEPTORS DUKE UNIVERSITY (US) 2010-09-30 US disclosed
US-7511624-B2 Optical detection of oscillating targets using modulation of scattered laser light MONTANA STATE UNIVERSITY (US) 2009-03-31 US disclosed
US-20090081154-A1 Attractant composition for yellowjackets STERLING INTERNATIONAL INC. 2009-03-26 US disclosed
US-20070157323-A1 In vivo odorant receptor systems and their uses YALE UNIVERSITY 2007-07-05 US disclosed
US-20060254522-A1 Optical detection of oscillating targets using modulation of scattered laser light MONTANA STATE UNIVERSITY 2006-11-16 US disclosed
WO-2005062780-A2 IN VIVO ODORANT RECEPTOR SYSTEMS AND THEIR USES YALE UNIVERSITY (US) 2005-07-14 WO disclosed
US-6740319-B2 ATTRACTANT COMPOSITION FOR YELLOWJACKETS COMPRISING VOLATILE COMPONENTS (A) AND (B) WHICH ACT SYNERGISTICALLY TO ATTRACT SAID YELLOWJACKETS, COMPONENT (A) COMPRISING (E)-2-HEXENAL AND RACEMIC ALPHA (-TERPINEOL OR (E)-2-HEXENAL AND RACEMIC THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE 2004-05-25 US disclosed
US-20030109581-A1 Chemical attractants for yellowjacket wasps AGRICULTURE, THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF 2003-06-12 US disclosed
US-6083498-A VAPOR BLEND OF ACETIC ACID AND ONE OR MORE COMPOUNDS SELECTED ISOBUTANOL, 2-METHYL-1-BUTANOL, 2-METHYL-2-PROPANOL, HEPTYL BUTYRATE, AND BUTYL BUTYRATE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2000-07-04 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 (4 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 ALDH1A1 978/4885TSHR 3246/4885DGKA 1682/4885
US-11357246-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 ALDH1A1 978/4885TSHR 3246/4885DGKA 1682/4885
US-20210227863-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 ALDH1A1 978/4885TSHR 3246/4885DGKA 1682/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 ALDH1A1 978/4885TSHR 3246/4885DGKA 1682/4885

“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.