SCHEMBL22845263

SCHEMBL22845263

CCC(=O)NC(C)(C)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 4/20 0.35
CYP2C9 P11712 1/20 0.34
CYP1A2 P05177 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
FFAR3 O14843 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
MAPK1 P28482 1/20 0.31
CCR6 P51684 1/20 0.31
MCL1 Q07820 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
PIK3CD O00329 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL23343787 0.80 ALDH1A1 (0.39) MEN1KMT2AALDH1A1CYP2C9CYP1A2
SCHEMBL25717760 0.79
SCHEMBL155565 0.78
SCHEMBL6356662 0.78
SCHEMBL28221562 0.76
SCHEMBL19407005 0.75 CYP2C9 (0.33) MEN1KMT2AALDH1A1CYP2C9PIK3CD
SCHEMBL1234217 0.74
SCHEMBL10312398 0.74 HPGD (0.52) MEN1KMT2AALDH1A1CYP2C9KDM4E
SCHEMBL22955846 0.74
SCHEMBL13154072 0.74 MEN1 (0.39) MEN1KMT2AALDH1A1CYP2C9CYP1A2

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-2020263935-A1 HCK DEGRADERS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-12-30 WO disclosed