SCHEMBL1868593

SCHEMBL1868593

Fc1ccccc1Nc1cscn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.56
AURKA O14965 2/20 0.45
MAPT P10636 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 3/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPK8 P45983 1/20 0.40
SCN1A P35498 4/20 0.39
SCN5A Q14524 4/20 0.39
SCN8A Q9UQD0 4/20 0.39
SCN1B Q07699 2/20 0.39
NR1I2 O75469 1/20 0.39
CYP2C9 P11712 1/20 0.39
SCN9A Q15858 1/20 0.39
SCN2A Q99250 1/20 0.39

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
SCHEMBL3822276 0.80 MAPK10 (0.36) MAPK10KDM4ESCN1ASCN5ASCN8A
SCHEMBL461146 0.73 KMT2A (0.48) AURKAMAPTMEN1KMT2AKDM4E
SCHEMBL7341519 0.72 MAPK10 (0.73) MAPK10AURKAMAPTMEN1KMT2A
SCHEMBL29796528 0.72 MAPK10 (0.73) MAPK10AURKAMAPTMEN1KMT2A
SCHEMBL1518965 0.71 MAPK10 (1.00) MAPK10AURKAMAPTMEN1KMT2A
SCHEMBL29793294 0.71 CXCL8 (0.55) MAPK10AURKAMAPTMEN1KMT2A
SCHEMBL396120 0.71 CXCL8 (0.55) MAPK10AURKAMAPTMEN1KMT2A
SCHEMBL20751634 0.69 NPC1 (0.42) MEN1KMT2AKDM4ERAB9ASMN1; SMN2
SCHEMBL1093291 0.69 SCN1A (0.55) SCN1ASCN5ASCN8ASCN1BNR1I2
SCHEMBL3951907 0.67 AURKA (0.56) MAPK10AURKAMAPTMEN1KMT2A

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-2498608-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GlaxoSmithKline LLC (US) 2012-09-19 EP disclosed
WO-2011059610-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-05-19 WO disclosed