SCHEMBL12197843

SCHEMBL12197843

COc1cccc(NS(=O)(=O)c2ccc(NC(=O)c3ccccn3)cc2)c1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.74
GAA P10253 2/20 0.74
GRM4 Q14833 6/20 0.72
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
PKM P14618 2/20 0.62
RXFP1 Q9HBX9 1/20 0.62
LMNA P02545 2/20 0.61
TSHR P16473 1/20 0.61
NAMPT P43490 1/20 0.60
AVPR2 P30518 2/20 0.60
GPR27 Q9NS67 2/20 0.60
HTT P42858 1/20 0.60
THRB P10828 1/20 0.59

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
SCHEMBL12197845 0.89 MAPT (0.80) MAPTGAAGRM4NPC1RAB9A
SCHEMBL12197847 0.85 GRM4 (0.76) MAPTGAAGRM4NPC1RAB9A
SCHEMBL27179438 0.85 MAPT (1.00) MAPTGAAGRM4NPC1RAB9A
SCHEMBL30926909 0.85 MAPT (1.00) MAPTGAAGRM4NPC1RAB9A
SCHEMBL2527996 0.85 GRM4 (1.00) MAPTGAAGRM4NPC1RAB9A
SCHEMBL12197875 0.84 LMNA (0.68) MAPTGAAGRM4NPC1RAB9A
SCHEMBL27180433 0.84 GRM4 (0.77) MAPTGAAGRM4NPC1RAB9A
SCHEMBL30926765 0.84 GRM4 (0.77) MAPTGAAGRM4NPC1RAB9A
SCHEMBL12197830 0.84 GRM4 (1.00) MAPTGAAGRM4NPC1RAB9A
SCHEMBL12197842 0.82 GRM4 (0.75) GAAGRM4NPC1RAB9ASMN1; SMN2

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-20110243844-A1 SULFONAMIDE DERIVATIVE METABOTROPIC GLUTAMATE R4 LIGANDS MERCK SHARP & DOHME CORP. 2011-10-06 US disclosed
US-20110243844-A1 SULFONAMIDE DERIVATIVE METABOTROPIC GLUTAMATE R4 LIGANDS MERCK SHARP & DOHME CORP. 2011-10-06 US disclosed
WO-2010033350-A1 SULFONAMIDE DERIVATIVE METABOTROPIC GLUTAMATE R4 LIGANDS MERCK & CO., INC. (US) 2010-03-25 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 (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-20110243844-A1 SULFONAMIDE DERIVATIVE METABOTROPIC GLUTAMATE R4 LIGANDS GRM4, GRIA4, GRM1 MAPT 1712/4885GAA 3243/4885GRM4 1/4885

“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.