SCHEMBL31705862

SCHEMBL31705862

COC(=O)c1csc(C2=CCOCC2)n1.COC(=O)c1csc(C2=CCOCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.46
▸ ACHE P22303 1/20 0.46
▸ RAB9A P51151 3/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ CLK1 P49759 1/20 0.38
▸ CRBN Q96SW2 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ PIK3CA P42336 4/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ MTOR P42345 3/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ULK1 O75385 1/20 0.34
▸ GCK P35557 1/20 0.33

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
SCHEMBL31706294 1.00 MAOA (0.46) MAOAACHERAB9ANPC1CLK1
SCHEMBL30482299 0.83 PLA2G10 (0.46) ACHEALDH1A1PIK3CAMTORHTR2C
Lithium Ion SCHEMBL31706112 0.81 PLA2G10 (0.34) RAB9ANPC1CLK1PIK3CAPIK3CD
Lithium Ion SCHEMBL31704985 0.81 PLA2G10 (0.34) RAB9ANPC1CLK1PIK3CAPIK3CD
SCHEMBL31706078 0.77 PIK3CA (0.37) MAPTALDH1A1PIK3CAPIK3CDMTOR
SCHEMBL31706525 0.77 PIK3CA (0.37) MAPTALDH1A1PIK3CAPIK3CDMTOR
SCHEMBL31704793 0.76 MAOA (0.46) MAOAACHERAB9ANPC1CLK1
SCHEMBL31706060 0.76 MAOA (0.46) MAOAACHERAB9ANPC1CLK1
SCHEMBL14656020 0.76 ACHE (0.64) MAOAACHERAB9ANPC1MAPT
SCHEMBL31706031 0.75 GCK (0.40) PIK3CAPIK3CDIRAK4GCK

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-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 — — WO disclosed
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