SCHEMBL31422940

SCHEMBL31422940

O=C(N[C@@H]1C=CS(=O)(=O)C1)c1cc2ccc(C3CC3)c(F)c2[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ CNR2 P34972 4/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B2 P37059 5/20 0.35
▸ HSD17B1 P14061 3/20 0.35
▸ SMYD3 Q9H7B4 2/20 0.34
▸ CHRNA7 P36544 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ POLB P06746 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
SCHEMBL31422941 1.00 MEN1 (0.41) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31422769 0.96 LMNA (0.40) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31422934 0.87 MEN1 (0.41) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31423325 0.85 HSD17B2 (0.42) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31422776 0.85 LMNA (0.42) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31423295 0.85 LMNA (0.42) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31422891 0.84 LMNA (0.47) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31422766 0.83 KMT2A (0.39) MEN1KMT2ALMNACNR2JAK2
SCHEMBL31423169 0.82 CNR2 (0.45) MEN1KMT2ALMNACNR2HSD17B2
SCHEMBL31273362 0.79 LMNA (0.44) MEN1KMT2ALMNAJAK2TP53

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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