SCHEMBL24967157

SCHEMBL24967157

Cc1ccc(SNc2ccc3c(c2)/C(=C/c2cn[nH]c2)C(=O)N3)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 1/20 0.47
▸ GSK3B P49841 8/20 0.44
▸ APP P05067 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PDPK1 O15530 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ LRRK2 Q5S007 3/20 0.41
▸ NOX4 Q9NPH5 1/20 0.41
▸ EGFR P00533 1/20 0.40
▸ ERBB2 P04626 1/20 0.40
▸ TLK2 Q86UE8 1/20 0.40
▸ AKT2 P31751 1/20 0.40

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
SCHEMBL24967156 0.82 PDPK1 (0.50) MAP4K1GSK3BPDPK1
SCHEMBL30155032 0.82 PDPK1 (0.50) MAP4K1GSK3BPDPK1
SCHEMBL30155136 0.82 PDPK1 (0.50) MAP4K1GSK3BPDPK1
SCHEMBL24967155 0.81 TLK2 (0.57) MAP4K1MAPTPDPK1MEN1KMT2A
SCHEMBL24967119 0.81 NPC1 (0.56) MAP4K1MAPTPDPK1MEN1KMT2A
SCHEMBL24966362 0.79 TLK2 (0.58) TLK2
SCHEMBL24966377 0.77 MEN1 (0.47) MAP4K1GSK3BMAPTPDPK1MEN1
SCHEMBL6001134 0.71 MAPT (0.62) GSK3BAPPMAPTMEN1KMT2A
SCHEMBL6001136 0.71 MAPT (0.62) GSK3BAPPMAPTMEN1KMT2A
SCHEMBL3804991 0.68 LRRK2 (0.75) LRRK2EGFRERBB2

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-2023001942-A1 14-3-3 PROTEIN MODULATORS AS ANTITUMOR AGENTS RAPPOSELLI SIMONA (IT) 2023-01-26 — — WO disclosed
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