SCHEMBL6759326

SCHEMBL6759326

CCCS(=O)(=O)NCC(C)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 11/20 0.67
TAAR1 Q96RJ0 1/20 0.49
AOC3 Q16853 1/20 0.49
GRIA2 P42262 1/20 0.44
LMNA P02545 1/20 0.42
KCNA5 P22460 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
GBA1 P04062 1/20 0.41
PTGES2 Q9H7Z7 1/20 0.41

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
SCHEMBL338392 1.00 GRIA4 (0.67) GRIA4TAAR1AOC3GRIA2LMNA
SCHEMBL6554408 1.00 GRIA4 (0.67) GRIA4TAAR1AOC3GRIA2LMNA
SCHEMBL6565123 0.91 GRIA4 (0.68) GRIA4GRIA2
SCHEMBL5992695 0.87 GRIA4 (0.71) GRIA4GRIA2
SCHEMBL6555617 0.84 GRIA4 (0.60) GRIA4GRIA2
SCHEMBL6554706 0.84 GRIA4 (0.60) GRIA4GRIA2
SCHEMBL6847064 0.84 GRIA4 (0.60) GRIA4GRIA2
SCHEMBL7031129 0.84 GRIA4 (0.60) GRIA4GRIA2
SCHEMBL6554686 0.84 GRIA4 (0.60) GRIA4GRIA2
SCHEMBL6936169 0.84 GRIA4 (0.60) GRIA4GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6720357-B2 TREATMENT OF CONDITIONS ASSOCIATED WITH GLUTAMATE HYPOFUNCTION, SUCH AS PSYCHIATRIC AND NEUROLOGICAL DISORDERS; N-2-(4-N-(3,5-DIFLUOROBENZAMIDO)PHENYL)PROPYL-2-PROPANESULFONAMIDE ELI LILLY AND COMPANY 2004-04-13 US disclosed