SCHEMBL25375641

SCHEMBL25375641

CCCC[C@](C)(COC)NC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
TDP1 Q9NUW8 1/20 0.32
THRB P10828 1/20 0.32
PKM P14618 1/20 0.32
EPHX1 P07099 2/20 0.32
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
AR P10275 1/20 0.30
PAM P19021 2/20 0.30
KDM4C Q9H3R0 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
SCHEMBL25375643 1.00 KMT2A (0.35) KMT2AL3MBTL1MEN1MAPTATM
SCHEMBL25375678 0.81 CTSK (0.38) KMT2AMEN1ALDH1A1CA1CA2
SCHEMBL25375682 0.81 CTSK (0.38) KMT2AMEN1ALDH1A1CA1CA2
SCHEMBL22832247 0.79 MEN1 (0.38) KMT2AL3MBTL1MEN1MAPTATM
SCHEMBL18109605 0.79 MEN1 (0.38) KMT2AL3MBTL1MEN1MAPTATM
SCHEMBL25375297 0.78 FDPS (0.38) KMT2AL3MBTL1MEN1MAPTATM
SCHEMBL25375302 0.78 FDPS (0.38) KMT2AL3MBTL1MEN1MAPTATM
SCHEMBL18131321 0.77 ANO1 (0.33) PKM
SCHEMBL18109547 0.74 MEN1 (0.44) KMT2AL3MBTL1MEN1MAPTATM
SCHEMBL18109544 0.74 MEN1 (0.44) KMT2AL3MBTL1MEN1MAPTATM

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-2023160527-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG 广东东阳光药业股份有限公司 2023-08-31 WO disclosed