SCHEMBL31423169

SCHEMBL31423169

COc1c(C2CCC2)ccc2cc(C(=O)N[C@@H]3C=CS(=O)(=O)C3)c(=O)[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 14/20 0.45
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HSD17B1 P14061 1/20 0.36
▸ HSD17B2 P37059 1/20 0.36
▸ POLB P06746 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PABPC1 P11940 1/20 0.35

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
SCHEMBL31423041 0.88 CNR2 (0.41) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31423269 0.88 LMNA (0.42) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31422934 0.87 MEN1 (0.41) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31422769 0.86 LMNA (0.40) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31422776 0.86 LMNA (0.42) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31423295 0.86 LMNA (0.42) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31422763 0.85 LMNA (0.40) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31422832 0.85 LMNA (0.40) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31422766 0.85 KMT2A (0.39) CNR2LMNAMEN1KMT2AHSD17B1
SCHEMBL31423325 0.85 HSD17B2 (0.42) CNR2LMNAMEN1KMT2AHSD17B1

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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