SCHEMBL1760302

SCHEMBL1760302

N#Cc1cc(COc2ccc(-c3cc(F)c(F)cc3F)cc2)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.48
CNR2 P34972 1/20 0.44
GYS1 P13807 4/20 0.43
FFAR1 O14842 3/20 0.43
AKR1B1 P15121 1/20 0.43
MAOB P27338 3/20 0.42
MAOA P21397 2/20 0.42
GSTP1 P09211 2/20 0.42
PTGES O14684 1/20 0.39

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
SCHEMBL1759569 0.87 GYS1 (0.53) CNR1GYS1FFAR1
SCHEMBL12595375 0.84 GSTP1 (0.54) CNR1FFAR1AKR1B1MAOBMAOA
SCHEMBL16841040 0.76 MAOB (0.49) CNR1MAOBMAOA
SCHEMBL28587983 0.75 XDH (0.61) MAOBMAOA
SCHEMBL2012370 0.73 GYS1 (0.52) GYS1MAOBGSTP1
SCHEMBL188284 0.72 MAOB (0.55) MAOBMAOA
Hydrochloric Acid SCHEMBL1767090 0.72 MAOB (0.56) GYS1MAOBGSTP1
SCHEMBL28572338 0.72 XDH (0.63) MAOBMAOA
SCHEMBL4753464 0.72 MAOB (0.74) MAOBMAOA
SCHEMBL21158608 0.71 PTGDR2 (0.48) CNR1FFAR1MAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947728-B1 Indole and indazole analogs as glycogen synthase activators HOFFMANN-LA ROCHE INC. (US) 2011-05-24 US disclosed
WO-2011057959-A1 INDOLE AND INDAZOLE DERIVATIVES AS GLYCOGEN SYNTHASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-05-19 WO disclosed
US-20110112161-A1 INDOLE AND INDAZOLE ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS BOLIN DAVID ROBERT 2011-05-12 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-20110112161-A1 INDOLE AND INDAZOLE ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS GYS2, PYGL, GSK3B CNR1 1963/4885CNR2 1810/4885GYS1 4/4885

“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.