SCHEMBL25100255

SCHEMBL25100255

C[C@@H]1CCCN1c1cc2c(c(CO)n1)CNC2=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 19/20 0.42
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL29261224 1.00 MAP4K1 (0.42) MAP4K1KDM4EMAPTL3MBTL1
SCHEMBL23987780 0.90 MAP4K1 (0.43) MAP4K1
SCHEMBL25099884 0.87 MAP4K1 (0.51) MAP4K1
SCHEMBL29261252 0.87 MAP4K1 (0.51) MAP4K1
SCHEMBL30233262 0.86 MAP4K1 (0.40) MAP4K1
SCHEMBL30233218 0.85 MAP4K1 (0.39) MAP4K1
SCHEMBL25099941 0.84 PIK3C3 (0.45)
SCHEMBL29261342 0.84 PIK3C3 (0.45)
SCHEMBL29261270 0.84 MAP4K1 (0.42) MAP4K1
SCHEMBL22011643 0.82 KDM4E (0.39) MAP4K1KDM4EMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118103369-A Pyridolactam derivatives, preparation method and application thereof 浙江海正药业股份有限公司 2024-05-28 CN disclosed
WO-2023030478-A1 PYRIDOLACTAM DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 浙江海正药业股份有限公司 2023-03-09 WO disclosed
WO-2023030478-A1 PYRIDOLACTAM DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 浙江海正药业股份有限公司 2023-03-09 WO disclosed