SCHEMBL26577880

SCHEMBL26577880

CCc1cc(CNC(=O)OC(C)(C)C)sc1C(C)=S

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.38
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
GAA P10253 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
GFER P55789 1/20 0.35
HSD17B10 Q99714 1/20 0.35
DYRK1A Q13627 1/20 0.35
GLS O94925 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CTSK P43235 1/20 0.34
HTT P42858 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNA1B Q00975 1/20 0.33

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
SCHEMBL10266596 0.74 KDM4A (0.44) KDM4AKDM4ELMNACA12CA1
SCHEMBL21411397 0.73 HDAC1 (0.38) KDM4AKDM4ELMNAGAAL3MBTL1
SCHEMBL21411380 0.72 KDM4E (0.46) KDM4AKDM4ELMNAGAAL3MBTL1
SCHEMBL31751451 0.71 KDM4A (0.38) KDM4ACA1CA2L3MBTL1TDP1
SCHEMBL18136849 0.70 KDM4A (0.41) KDM4AKDM4ELMNAGAAL3MBTL1
SCHEMBL30466780 0.69 ALDH1A1 (0.48) KDM4AKDM4ELMNACA12CA1
SCHEMBL26759908 0.68 L3MBTL1 (0.39) KDM4AKDM4ELMNACA12CA1
SCHEMBL14877950 0.68 KDM4A (0.47) KDM4AKDM4ELMNACA12CA1
SCHEMBL31486392 0.68 KDM4A (0.44) KDM4AKDM4ELMNACA12CA1
SCHEMBL14036623 0.68 KDM4A (0.44) KDM4AKDM4ELMNAGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023183405-A2 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2023-09-28 WO disclosed