SCHEMBL31422776

SCHEMBL31422776

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CNR2 P34972 4/20 0.35
▸ HSD17B1 P14061 2/20 0.35
▸ HSD17B2 P37059 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ SMYD3 Q9H7B4 2/20 0.33
▸ RECQL P46063 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 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
SCHEMBL31423295 1.00 LMNA (0.42) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31422934 0.90 MEN1 (0.41) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31422769 0.89 LMNA (0.40) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31422766 0.87 KMT2A (0.39) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31423325 0.87 HSD17B2 (0.42) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31423169 0.86 CNR2 (0.45) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31423174 0.85 LMNA (0.49) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31423269 0.85 LMNA (0.42) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31422941 0.85 MEN1 (0.41) LMNAMEN1KMT2ACNR2HSD17B1
SCHEMBL31422940 0.85 MEN1 (0.41) LMNAMEN1KMT2ACNR2HSD17B1

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
Send feedback