SCHEMBL4943907

SCHEMBL4943907

Cc1c(OCCCCSc2ccccn2)ccc(C(=O)CC(C)C)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 1.00

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
SCHEMBL4943594 0.85 GRM2 (1.00) GRM2
SCHEMBL4940249 0.84 GRM2 (1.00) GRM2
SCHEMBL4944338 0.83 GRM2 (1.00) GRM2
SCHEMBL4945443 0.83 GRM2 (0.78) GRM2
SCHEMBL4943539 0.83 GRM2 (0.81) GRM2
SCHEMBL4944421 0.81 GRM2 (0.74) GRM2
SCHEMBL4937161 0.80 GRM2 (0.67) GRM2
SCHEMBL18472945 0.80 GRM2 (0.76) GRM2
SCHEMBL25289260 0.80 GRM2 (0.71) GRM2
SCHEMBL4946414 0.80 GRM2 (0.71) GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293684-A1 Heterocyclic Acetophenone Potentiators of Metabotropic Glutamate Receptors MERCK SHARP & DOHME CORP. 2008-11-27 US claimed
EP-1773774-A2 HETEROCYCLIC ACETOPHENONE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS Merck & Co., Inc. (US) 2007-04-18 EP claimed
WO-2006014918-A2 HETEROCYCLIC ACETOPHENONE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERCK & CO., INC. (US) 2006-02-09 WO claimed
US-10377695-B2 Metabotropic glutamate receptor positive allosteric modulators (PAMS) and uses thereof Sanford Burnham Prebys Medical Discovery Institute (US) 2019-08-13 US disclosed
US-20180194710-A1 Metabotropic Glutamate Receptor Positive Allosteric Modulators (PAMS) and Uses Thereof Sanford Burnham Prebys Medical Discovery Institute 2018-07-12 US disclosed
US-20180194710-A1 Metabotropic Glutamate Receptor Positive Allosteric Modulators (PAMS) and Uses Thereof Sanford Burnham Prebys Medical Discovery Institute 2018-07-12 US disclosed
US-20170036987-A1 Metabotropic Glutamate Receptor Positive Allosteric Modulators (PAMS) and Uses Thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-02-09 US disclosed
US-20170036987-A1 Metabotropic Glutamate Receptor Positive Allosteric Modulators (PAMS) and Uses Thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-02-09 US disclosed
WO-2015157187-A1 METABOTROPIC GLUTAMATE RECEPTOR POSITIVE ALLOSTERIC MODULATORS (PAMS) AND USES THEREOF SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-10-15 WO disclosed
US-20080293684-A1 Heterocyclic Acetophenone Potentiators of Metabotropic Glutamate Receptors MERCK SHARP & DOHME CORP. 2008-11-27 US disclosed
US-20080293684-A1 Heterocyclic Acetophenone Potentiators of Metabotropic Glutamate Receptors MERCK SHARP & DOHME CORP. 2008-11-27 US disclosed
US-20080293684-A1 Heterocyclic Acetophenone Potentiators of Metabotropic Glutamate Receptors MERCK SHARP & DOHME CORP. 2008-11-27 US disclosed
WO-2006014918-A2 HETEROCYCLIC ACETOPHENONE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERCK & CO., INC. (US) 2006-02-09 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-20170036987-A1 Metabotropic Glutamate Receptor Positive Allosteric Modulators (PAMS) and Uses Thereof GRM3, GRM2, GRM1 GRM2 2/4885
US-10377695-B2 Metabotropic glutamate receptor positive allosteric modulators (PAMS) and uses thereof GRM3, GRM2, GRM1 GRM2 2/4885
US-20080293684-A1 Heterocyclic Acetophenone Potentiators of Metabotropic Glutamate Receptors GRM2, GRM1, GRIK2 GRM2 1/4885
US-20180194710-A1 Metabotropic Glutamate Receptor Positive Allosteric Modulators (PAMS) and Uses Thereof GRM3, GRM2, GRM1 GRM2 2/4885

“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.