SCHEMBL28935720

SCHEMBL28935720

CCOC(=O)Cc1cn(C(=O)OC(C)(C)C)c2ncsc12

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HTR6 P50406 1/20 0.33
DPP4 P27487 2/20 0.32
TBXAS1 P24557 1/20 0.32
LMNA P02545 1/20 0.32
KCNH2 Q12809 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SRC P12931 4/20 0.32
MAPK1 P28482 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
SCHEMBL28935600 0.84 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL28935725 0.82 L3MBTL1 (0.56) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL1996984 0.80 L3MBTL1 (0.65) L3MBTL1SMN1; SMN2KDM4EHTR6
SCHEMBL28935556 0.79 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL28935608 0.79 L3MBTL1 (0.52) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL28935669 0.77 L3MBTL1 (0.50) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL1998282 0.75 L3MBTL1 (0.65) L3MBTL1SMN1; SMN2MEN1KMT2AHTR6
SCHEMBL12024535 0.74 L3MBTL1 (0.70) L3MBTL1KMT2AKDM4EHTR6TBXAS1
SCHEMBL1996783 0.73 L3MBTL1 (0.61) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL5740608 0.72 L3MBTL1 (1.00) L3MBTL1SMN1; SMN2MEN1KMT2AKDM4E

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
CN-115611895-A Arylamino derivative estrogen receptor modulators and uses thereof 四川海思科制药有限公司 2023-01-17 CN disclosed