SCHEMBL30596305

SCHEMBL30596305

CC(=O)NCCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.40
TGFBR1 P36897 2/20 0.40
EPHX2 P34913 3/20 0.38
FOLH1 Q04609 1/20 0.38
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
NMT2 O60551 1/20 0.37
NMT1 P30419 1/20 0.37
SIRT5 Q9NXA8 1/20 0.36

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
SCHEMBL30596304 1.00 MME (0.40) MMETGFBR1EPHX2FOLH1FNTA
SCHEMBL30596303 0.81 MME (0.43) MMETGFBR1FNTAFNTBNMT2
SCHEMBL30596302 0.79 NOD1 (0.51)
SCHEMBL3396651 0.78 MME (0.45) MMETGFBR1FNTAFNTB
SCHEMBL3396644 0.78 MME (0.45) MMETGFBR1FNTAFNTB
SCHEMBL31456260 0.74 MME (0.47) MMETGFBR1FOLH1FNTAFNTB
SCHEMBL29584346 0.73 MME (0.46) MMETGFBR1FNTAFNTB
SCHEMBL30099466 0.72 MME (0.45) MMETGFBR1FNTAFNTB
SCHEMBL30439049 0.72 MME (0.45) MMETGFBR1FNTAFNTB
SCHEMBL28220833 0.72 MME (0.42) MMETGFBR1FNTAFNTB

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-116806157-A Linker-payload and conjugates thereof 芬兰吉利科斯有限公司 2023-09-26 CN disclosed