SCHEMBL4968801

SCHEMBL4968801

CCC(=O)Oc1csc(NC(C)=O)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
PI4KB Q9UBF8 1/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 4/20 0.46
HSD17B10 Q99714 4/20 0.46
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
ABL1 P00519 3/20 0.43
MAPK1 P28482 2/20 0.43
AOC3 Q16853 1/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 3/20 0.42
HTT P42858 2/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42

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
SCHEMBL6172805 0.84 L3MBTL1 (0.56) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A
SCHEMBL27799601 0.77 SMN1; SMN2 (0.54) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL27799074 0.76 SMN1; SMN2 (0.40) SMN1; SMN2KMT2ANPC1RAB9AKDM4E
SCHEMBL27512024 0.75 CYP1A2 (0.46) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A
SCHEMBL27537297 0.75 ALDH1A1 (0.50) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A
SCHEMBL27336449 0.74 ALDH1A1 (0.47) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A
SCHEMBL27431258 0.74 KMT2A (0.39) SMN1; SMN2KMT2ANPC1RAB9AHSD17B10
SCHEMBL27338326 0.74 KMT2A (0.35) SMN1; SMN2KMT2ANPC1RAB9AHSD17B10
SCHEMBL10850013 0.74 MEN1 (0.39) SMN1; SMN2KMT2ANPC1RAB9AMAPT
Hydrochloric Acid SCHEMBL6216370 0.73 ALDH1A1 (0.50) SMN1; SMN2KMT2AL3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981884-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS Amgen, Inc (US) 2008-10-22 EP disclosed
WO-2007084391-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B ( PKB) INHIBITORS AMGEN INC. (US) 2007-07-26 WO disclosed
EP-1587800-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS Astellas Pharma Inc. (JP) 2005-10-26 EP disclosed
WO-2004067521-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS ASTELLAS PHARMA INC. (JP) 2004-08-12 WO disclosed