SCHEMBL28896256

SCHEMBL28896256

CCOC(=O)c1[nH]ccc1NCC(CNC(=O)OC(C)(C)C)OCC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
KDM4E B2RXH2 5/20 0.36
NPSR1 Q6W5P4 3/20 0.36
SERPINE1 P05121 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
SYK P43405 1/20 0.34
AAK1 Q2M2I8 1/20 0.33
ATM Q13315 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
JAK1 P23458 1/20 0.31
POLB P06746 2/20 0.31
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
PDK4 Q16654 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL28896258 0.87 MAPT (0.36) MAPTKDM4ENPSR1SERPINE1TDP1
SCHEMBL28896573 0.84 KDM4E (0.34) KDM4ENPSR1POLBPDK1PDK2
SCHEMBL28896498 0.82 SYK (0.38) MAPTKDM4ENPSR1SERPINE1TDP1
SCHEMBL28896379 0.78 KDM4E (0.32) MAPTKDM4ENPSR1SERPINE1TDP1
SCHEMBL28896542 0.75 AAK1 (0.45) MAPTKDM4ENPSR1TDP1SYK
SCHEMBL28896541 0.75 AAK1 (0.45) MAPTKDM4ENPSR1TDP1SYK
SCHEMBL28896488 0.75 SMN1; SMN2 (0.36) MAPTKDM4ENPSR1TDP1LMNA
SCHEMBL28896499 0.75 SYK (0.38) MAPTKDM4ENPSR1SERPINE1TDP1
SCHEMBL4393322 0.74 KDM4E (0.41) MAPTKDM4ENPSR1LMNAL3MBTL1
SCHEMBL28896250 0.72 PTGER4 (0.38) MAPTKDM4ENPSR1PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115403584-B 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
CN-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 CN disclosed