SCHEMBL12197943

SCHEMBL12197943

O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2OCc2ccccn2)cc1)c1ccccn1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 7/20 0.66
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 2/20 0.55
PKM P14618 1/20 0.55
GAA P10253 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
BDKRB1 P46663 1/20 0.53

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
SCHEMBL12197842 0.87 GRM4 (0.75) GRM4SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL1970027 0.80 GRM4 (1.00) GRM4SMN1; SMN2NPC1RAB9AHTT
SCHEMBL12197881 0.79 GRM4 (0.76) GRM4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL12197890 0.79 GRM4 (1.00) GRM4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL12197905 0.79 GRM4 (0.76) GRM4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL12197850 0.79 GRM4 (0.76) GRM4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL12197875 0.78 LMNA (0.68) GRM4SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL12197933 0.78 BDKRB1 (0.83) GRM4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL12197930 0.78 BDKRB1 (0.76) GRM4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL12197916 0.78 GRM4 (0.70) GRM4SMN1; SMN2NPC1RAB9ALMNA

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 GRM4 1/4885SMN1; SMN2 790/4885NPC1 2618/4885

“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.