SCHEMBL13464342

SCHEMBL13464342

CCCSc1nc(N)c(N)c(Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
HPGD P15428 3/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 5/20 0.37
GAA P10253 2/20 0.37
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HASPIN Q8TF76 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
NPC1 O15118 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32

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
SCHEMBL29388389 1.00 ALDH1A1 (0.44) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL595428 0.90 ALDH1A1 (0.48) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL13192768 0.84 ALDH1A1 (0.43) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL14889179 0.80 ALDH1A1 (0.40) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL20668832 0.80 LMNA (0.40) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL21268666 0.80 ALDH1A1 (0.40) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL1389181 0.79 SMN1; SMN2 (0.45) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL8681369 0.79 ALDH1A1 (0.46) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL21268691 0.79 LMNA (0.37) ALDH1A1HPGDLMNAKMT2AKDM4E
SCHEMBL21268640 0.78 LMNA (0.39) ALDH1A1HPGDLMNAKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed
CN-111978327-B Preparation method of ticagrelor 南京一心和医药科技有限公司 2022-06-10 CN disclosed
CN-111978327-A Preparation method of ticagrelor 南京一心和医药科技有限公司 2020-11-24 CN disclosed
CN-107580596-A For treating and preventing the new sulphur imido acyl group purinone compound and derivative of virus infection 豪夫迈·罗氏有限公司 2018-01-12 CN disclosed
US-9604991-B2 Preparation method of ticagrelor and intermediates thereof SUZHOU MIRACPHARMA TECHNOLOGY CO., LTD. (CN) 2017-03-28 US disclosed
WO-2013092900-A1 SYNTHESIS OF TRIAZOLOPYRIMIDINE COMPOUNDS LEK PHARMACEUTICALS D.D. (SI) 2013-06-27 WO disclosed
WO-2010030224-A1 A PROCESS FOR PREPARING [1S- [1-ALPHA, 2-ALPHA, 3-BETA (1S*, 2R*) 5-BETA] ] -3- [7- [2- (3, 4-DIF LUOROPHENYL) -CYCLOPROPYLAMINO] - 5- (PROPYLTHIO) -3H-1, 2, 3-TRIAZOLO [4, 5-D] PYRIMIDIN-3-YL] -5- (2- HYDROXYETHOXY) CYCLOPENTANE-1, 2-DIOL AND TO ITS INTERMEDIATES ASTRAZENECA AB (SE) 2010-03-18 WO disclosed