SCHEMBL25909784

SCHEMBL25909784

CC1CCn2c(ncc(C(C)C)c2=O)C1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM5A P29375 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
USP1 O94782 1/20 0.31
LMNA P02545 2/20 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
SCHEMBL23108875 0.80 LMNA (0.32) MAP4K1LMNA
SCHEMBL23108633 0.80 LMNA (0.32) MAP4K1LMNA
SCHEMBL23107347 0.74 MAP4K1 (0.32) MAP4K1LMNA
SCHEMBL23106882 0.74 MAP4K1 (0.32) MAP4K1LMNA
SCHEMBL23106904 0.74 MAP4K1 (0.32) MAP4K1LMNA
SCHEMBL27414736 0.73 MAPK1 (0.44) L3MBTL1LMNA
SCHEMBL23089487 0.72 ALDH1A1 (0.34) MAP4K1LMNA
SCHEMBL23133738 0.70 CPB2 (0.38) MAP4K1L3MBTL1LMNA
SCHEMBL23103528 0.70 CPB2 (0.38) MAP4K1L3MBTL1LMNA
SCHEMBL23114542 0.70 MAP4K1 (0.32) MAP4K1LMNA

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-2023125812-A1 SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2023-07-06 WO disclosed