SCHEMBL1674768

SCHEMBL1674768

CC(C)CC(C(=O)O)N(C(=O)CN)C(=O)C(N)CCCCN

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.46
SLC7A5 Q01650 1/20 0.38
SLC1A2 P43004 4/20 0.36
SLC1A3 P43003 3/20 0.36
SLC1A1 P43005 3/20 0.36
RNPEP Q9H4A4 1/20 0.35
GRIK1 P39086 2/20 0.34
GRIK2 Q13002 2/20 0.34
ERAP2 Q6P179 1/20 0.33
ERAP1 Q9NZ08 1/20 0.33
LNPEP Q9UIQ6 1/20 0.33
THRB P10828 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
CPB2 Q96IY4 2/20 0.33

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
SCHEMBL27639943 1.00 GSR (0.46) GSRSLC7A5SLC1A2SLC1A3SLC1A1
SCHEMBL2887202 0.87 GSR (0.53) GSRRNPEPGNAI3GNAO1GNAI1
SCHEMBL27814766 0.83 GSR (0.46) GSRRNPEPCPB2
SCHEMBL18613506 0.81 SLC7A5 (0.41) SLC7A5SLC1A2SLC1A3SLC1A1RNPEP
SCHEMBL15757064 0.79 SLC7A5 (0.43) SLC7A5SLC1A2SLC1A3SLC1A1RNPEP
Hydrochloric Acid SCHEMBL15512475 0.78 GSR (0.46) GSRSLC7A5SLC1A2SLC1A3SLC1A1
SCHEMBL28624838 0.78 GSR (0.45) GSRRNPEPTHRBCPB2
SCHEMBL8931572 0.78 GSR (0.60) GSRRNPEPGNAI3GNAO1GNAI1
SCHEMBL5556166 0.78 GSR (0.60) GSRRNPEPGNAI3GNAO1GNAI1
SCHEMBL18043461 0.77 GSR (0.51) GSRRNPEPTHRBGNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103597071-A Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS INC 2014-02-19 CN claimed
EP-2661266-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES Elcelyx Therapeutics, Inc. (US) 2013-11-13 EP claimed
WO-2012094636-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ELCELYX THERAPEUTICS, INC. (US) 2012-07-12 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
EP-3763419-A1 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES Anji Pharma (US) LLC (US) 2021-01-13 EP disclosed
EP-2661266-B1 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ANJI PHARMA (US) LLC (US) 2020-09-16 EP disclosed
WO-2012094636-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ELCELYX THERAPEUTICS, INC. (US) 2012-07-12 WO disclosed
WO-2012054528-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ELCELYX THERAPEUTICS, INC. (US) 2012-04-26 WO disclosed
US-20110177545-A1 G-PROTEINS GIVAUDAN SA (CH) 2011-07-21 US disclosed
US-7919236-B2 G-proteins GIVAUDAN SA (CH) 2011-04-05 US disclosed
EP-1581555-B1 CHIMERIC ALPHA Q-GUSTDUCIN G-PROTEINS GIVAUDAN SA (CH) 2008-04-30 EP disclosed
US-20060275765-A1 G-proteins GIVAUDAN SA (CH) 2006-12-07 US disclosed
CN-1726224-A Chimeric alpha Q-gustducin G-proteins GIVAUDAN SA (CH) 2006-01-25 CN disclosed
EP-1581555-A2 G-PROTEINS Givaudan SA (CH) 2005-10-05 EP disclosed
WO-2004055048-A2 CHIMERIC ALPHA Q-GUSTDUCIN G-PROTEINS GIVAUDAN SA (CH) 2004-07-01 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 (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 GSR 2160/4885SLC7A5 61/4885SLC1A2 412/4885
US-11357246-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 GSR 2160/4885SLC7A5 61/4885SLC1A2 412/4885
US-20210227863-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 GSR 2160/4885SLC7A5 61/4885SLC1A2 412/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 GSR 2160/4885SLC7A5 61/4885SLC1A2 412/4885

“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.