SCHEMBL25828179

SCHEMBL25828179

CC(=O)Sc1ccc(Cc2nc(C(N)=O)n[nH]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 3/20 0.39
HDAC6 Q9UBN7 1/20 0.36
RIPK1 Q13546 13/20 0.34
NR1I2 O75469 1/20 0.33
CYP2C9 P11712 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
SCHEMBL24193842 0.79 ALPL (0.48) KLKB1HDAC6RIPK1
SCHEMBL23085471 0.79 NR1H2 (0.53) KLKB1HDAC6RIPK1
SCHEMBL3829567 0.74 CA2 (0.49) CYP2C9
SCHEMBL14367128 0.73 KMT2A (0.52) HDAC6CYP2C9
SCHEMBL24193687 0.71 ALPL (0.48) KLKB1HDAC6RIPK1
SCHEMBL24167145 0.70 NR1H2 (0.53) KLKB1HDAC6RIPK1
SCHEMBL29757046 0.69 HCAR2 (0.50) KLKB1RIPK1
SCHEMBL21889873 0.68 KDM4E (0.35)
SCHEMBL10187470 0.67 LMNA (0.58)
SCHEMBL9733928 0.67 AR (0.40) KLKB1RIPK1

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-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed