SCHEMBL31422766

SCHEMBL31422766

O=C(N[C@@H]1C=CS(=O)(=O)C1)c1cc2ccc(C3CCC3)c(CO)c2[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CNR2 P34972 4/20 0.36
▸ HSD17B1 P14061 2/20 0.35
▸ HSD17B2 P37059 2/20 0.35
▸ JAK2 O60674 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ SMYD3 Q9H7B4 2/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ POLB P06746 3/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ PABPC1 P11940 1/20 0.31

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
SCHEMBL31422934 0.88 MEN1 (0.41) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31423295 0.87 LMNA (0.42) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31422769 0.87 LMNA (0.40) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31422776 0.87 LMNA (0.42) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31423325 0.85 HSD17B2 (0.42) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31423041 0.85 CNR2 (0.41) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31423169 0.85 CNR2 (0.45) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31422941 0.83 MEN1 (0.41) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31422940 0.83 MEN1 (0.41) KMT2AMEN1LMNACNR2HSD17B1
SCHEMBL31423174 0.82 LMNA (0.49) KMT2AMEN1LMNACNR2HSD17B1

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-2025085233-A1 NOVEL DERIVATIVES OF QUINOLINONES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-04-24 — — WO disclosed
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