SCHEMBL2011184

SCHEMBL2011184

CCOC(=O)CNCc1cccc(COc2ccc(-c3ccc(F)cc3F)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GYS1 P13807 4/20 0.57
MAOB P27338 6/20 0.44
F10 P00742 1/20 0.44
FFAR1 O14842 1/20 0.43
PPARD Q03181 1/20 0.43
LTA4H P09960 2/20 0.42
MAOA P21397 1/20 0.42
SCN9A Q15858 1/20 0.42
NR4A2 P43354 1/20 0.42

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
Hydrochloric Acid SCHEMBL2014675 0.99 GYS1 (0.56) GYS1MAOBF10FFAR1PPARD
SCHEMBL2015052 0.85 GYS1 (0.79) GYS1FFAR1PPARD
Hydrochloric Acid SCHEMBL2015491 0.84 GYS1 (0.78) GYS1FFAR1PPARD
SCHEMBL3498654 0.78 MAOB (0.53) MAOBLTA4HNR4A2
SCHEMBL1756359 0.77 MRGPRX4 (0.67) GYS1MAOBF10NR4A2
SCHEMBL1756377 0.75 MRGPRX4 (0.65) NR4A2
SCHEMBL5229166 0.74 BCHE (0.62) MAOBFFAR1LTA4H
SCHEMBL2029459 0.74 MAOB (0.49) GYS1MAOBF10FFAR1MAOA
SCHEMBL548 0.74 LTA4H (0.64) LTA4H
SCHEMBL1762312 0.73 GYS1 (0.62) GYS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011067266-A1 CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-06-09 WO disclosed
WO-2011067266-A1 CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-06-09 WO disclosed
US-20110136792-A1 NOVEL CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS BOLIN DAVID ROBERT 2011-06-09 US disclosed
US-20110136792-A1 NOVEL CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS BOLIN DAVID ROBERT 2011-06-09 US disclosed
US-20110136792-A1 NOVEL CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS BOLIN DAVID ROBERT 2011-06-09 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 (1 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-20110136792-A1 NOVEL CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS GYS2, GYS1, PYGL GYS1 2/4885MAOB 1010/4885F10 3972/4885

“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.