SCHEMBL24880875

SCHEMBL24880875

CCC1(O)CCc2cc(Cl)c(Br)nc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.32

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
SCHEMBL24881023 0.83 TDP1 (0.31)
SCHEMBL24881008 0.82
SCHEMBL21334000 0.74 MAP3K14 (0.32) MAP3K14
SCHEMBL21349674 0.74 MAP3K14 (0.32) MAP3K14
SCHEMBL21332753 0.74 MAP3K14 (0.32) MAP3K14
SCHEMBL23364873 0.74 MAP3K14 (0.38) MAP3K14
SCHEMBL22532060 0.74 MAP3K14 (0.38) MAP3K14
SCHEMBL29828611 0.74 MAP3K14 (0.38) MAP3K14
SCHEMBL30496896 0.74 MAP3K14 (0.38) MAP3K14
SCHEMBL24880874 0.73 MAP3K14 (0.32) MAP3K14

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-2023280180-A1 FUSED RING COMPOUND AS WEE-1 INHIBITOR 微境生物医药科技(上海)有限公司 2023-01-12 WO disclosed