SCHEMBL6780319

SCHEMBL6780319

CC(CNS(=O)(=O)C(C)C)c1ccc(OCCOc2ccccc2C#N)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 12/20 0.56
GRIA2 P42262 2/20 0.56
GRIA1 P42261 1/20 0.56
GRIA3 P42263 1/20 0.56
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 2/20 0.40
ADRB1 P08588 1/20 0.39
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
MAOA P21397 1/20 0.38
HTR2B P41595 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6782571 0.85 GRIA4 (0.76) GRIA4GRIA2GRIA1GRIA3ALDH1A1
SCHEMBL6783524 0.84 GRIA4 (0.55) GRIA4GRIA2GRIA1GRIA3ALDH1A1
SCHEMBL6782561 0.84 GRIA4 (0.68) GRIA4GRIA2GRIA1GRIA3ALDH1A1
SCHEMBL6784166 0.83 GRIA4 (0.60) GRIA4GRIA2GRIA1GRIA3TDP1
SCHEMBL6783556 0.81 GRIA4 (0.60) GRIA4GRIA2GRIA1GRIA3
SCHEMBL6780379 0.80 GRIA4 (0.55) GRIA4GRIA2GRIA1GRIA3
SCHEMBL6782446 0.80 GRIA4 (0.66) GRIA4GRIA2GRIA1GRIA3ALDH1A1
SCHEMBL6782230 0.79 GRIA4 (0.55) GRIA4GRIA2GRIA1GRIA3
SCHEMBL6779663 0.79 LMNA (0.58) GRIA4GRIA2GRIA1GRIA3SMN1; SMN2
SCHEMBL6779076 0.79 GRIA4 (0.56) GRIA4GRIA2GRIA1GRIA3RAB9A

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
US-6693137-B1 GLUTAMATE RECEPTOR POTENTIATION ELI LILLY AND COMPANY 2004-02-17 US claimed
US-6693137-B1 GLUTAMATE RECEPTOR POTENTIATION ELI LILLY AND COMPANY 2004-02-17 US disclosed
EP-0994110-B1 Sulphonamide derivatives LILLY CO ELI (US) 2003-05-14 EP disclosed
EP-0994110-A1 Sulphonamide derivatives ELI LILLY AND COMPANY (US) 2000-04-19 EP disclosed
WO-2000006148-A1 SULPHONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed