SCHEMBL29025899

SCHEMBL29025899

CC(N/C(=C/C(=O)O)NC(=O)NCc1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.49
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TP53 P04637 1/20 0.47
CASR P41180 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ANPEP P15144 2/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HSD17B10 Q99714 1/20 0.43
ATM Q13315 1/20 0.43
PPIA P62937 1/20 0.43

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
SCHEMBL16321397 1.00 EPHX2 (0.49) EPHX2ALDH1A1MAPTL3MBTL1TP53
SCHEMBL16321396 1.00 EPHX2 (0.49) EPHX2ALDH1A1MAPTL3MBTL1TP53
SCHEMBL16321395 1.00 EPHX2 (0.49) EPHX2ALDH1A1MAPTL3MBTL1TP53
SCHEMBL16321398 1.00 EPHX2 (0.49) EPHX2ALDH1A1MAPTL3MBTL1TP53
SCHEMBL16356140 0.86 MAPT (0.48) EPHX2ALDH1A1MAPTL3MBTL1TP53
SCHEMBL6436940 0.82 EPHX2 (0.68) EPHX2ALDH1A1MAPTL3MBTL1CASR
SCHEMBL17232942 0.79 GPR139 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2TDP1
SCHEMBL17232940 0.79 GPR139 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2TDP1
SCHEMBL17232943 0.79 GPR139 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2TDP1
SCHEMBL17232941 0.79 GPR139 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2TDP1

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-109384729-B Pyrimidinedione compounds for cardiac disorders 迈奥卡迪亚公司 2023-06-30 CN disclosed