SCHEMBL8624375

SCHEMBL8624375

O=S1(=O)NCN(C2CCCCCCC2)c2ccncc21

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 14/20 0.56
GRIA1 P42261 3/20 0.51
GRIA3 P42263 3/20 0.51
GRIA4 P48058 3/20 0.51
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL8627047 1.00 GRIA2 (0.56) GRIA2GRIA1GRIA3GRIA4JAK2
SCHEMBL2776314 0.76 GRIA2 (0.87) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2776216 0.76 GRIA2 (0.87) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2779056 0.76 GRIA2 (0.87) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2775051 0.74 GRIA2 (0.89) GRIA2GRIA1GRIA3GRIA4
SCHEMBL8561528 0.74 GRIA2 (0.50) GRIA2GRIA1GRIA3GRIA4
SCHEMBL2777251 0.73 GRIA2 (0.62) GRIA2GRIA1GRIA3GRIA4KDM4E
SCHEMBL2776022 0.73 GRIA2 (0.62) GRIA2GRIA1GRIA3GRIA4KDM4E
SCHEMBL2775610 0.73 GRIA2 (0.62) GRIA2GRIA1GRIA3GRIA4KDM4E
SCHEMBL2775511 0.73 GRIA2 (0.62) GRIA2GRIA1GRIA3GRIA4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618209-B1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-12-23 EP disclosed
EP-0618209-A1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-10-05 EP disclosed