SCHEMBL31423325

SCHEMBL31423325

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

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HSD17B2 P37059 14/20 0.42
▸ HSD17B1 P14061 8/20 0.42
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CNR2 P34972 4/20 0.35
▸ JAK2 O60674 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL31422769 0.89 LMNA (0.40) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31422934 0.88 MEN1 (0.41) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31422776 0.87 LMNA (0.42) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31423295 0.87 LMNA (0.42) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31422766 0.85 KMT2A (0.39) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31422940 0.85 MEN1 (0.41) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31422941 0.85 MEN1 (0.41) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31423169 0.85 CNR2 (0.45) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31423269 0.82 LMNA (0.42) HSD17B2HSD17B1MEN1LMNAKMT2A
SCHEMBL31423174 0.82 LMNA (0.49) HSD17B2HSD17B1MEN1LMNAKMT2A

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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