SCHEMBL2643973

SCHEMBL2643973

CC(=O)c1ccccc1Oc1ccc(N)c(C(=O)Nc2nc(C)cs2)c1

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 17/20 0.80
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ RCE1 Q9Y256 1/20 0.53
▸ L3MBTL1 Q9Y468 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
SCHEMBL2642904 0.92 GCK (0.80) GCKNPC1RAB9AKDM4EALDH1A1
SCHEMBL2642949 0.89 GCK (0.81) GCKNPC1RAB9AKDM4EALDH1A1
SCHEMBL2643117 0.89 GCK (1.00) GCKNPC1RAB9AKDM4EHPGD
SCHEMBL2643299 0.86 GCK (0.77) GCK
SCHEMBL2642293 0.86 GCK (0.77) GCKNPC1RAB9AKDM4E
SCHEMBL2642565 0.85 GCK (0.76) GCK
SCHEMBL14380059 0.85 GCK (1.00) GCK
SCHEMBL2643904 0.84 GCK (0.83) GCKNPC1RAB9AKDM4EHPGD
SCHEMBL2642527 0.84 GCK (0.73) GCKNPC1RAB9AKDM4EALDH1A1
SCHEMBL2643497 0.83 GCK (1.00) GCK

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
EP-1496052-B1 NOVEL AMINOBENZAMIDE DERIVATIVE BANYU PHARMA CO LTD (JP) 2009-08-05 — — EP disclosed
US-7253188-B2 Aminobenzamide derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-07 — — US disclosed
US-7253188-B2 Aminobenzamide derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-07 — — US disclosed
US-7253188-B2 Aminobenzamide derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-07 — — US disclosed
EP-1496052-A1 NOVEL AMINOBENZAMIDE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-01-12 — — EP disclosed
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