SCHEMBL25802809

SCHEMBL25802809

COc1cc(C)c(C)c(S(=O)(=O)Nc2ccc(N3CCC(C(=O)O)C3)c3ccccc23)c1C

nearest known ligand 0.85

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 11/20 0.85
▸ NFE2L2 Q16236 4/20 0.85
▸ NOTUM Q6P988 5/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CRHBP P24387 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ APOBEC3G Q9HC16 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL24811431 1.00 KEAP1 (0.85) KEAP1NFE2L2NOTUMKDM4EALDH1A1
SCHEMBL17599442 0.92 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EALDH1A1
SCHEMBL17599452 0.92 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EALDH1A1
SCHEMBL17599491 0.92 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EALDH1A1
SCHEMBL29584677 0.92 KEAP1 (1.00) KEAP1NFE2L2NOTUMKDM4EALDH1A1
SCHEMBL24811433 0.89 KEAP1 (0.89) KEAP1NFE2L2NOTUMKDM4EALDH1A1
SCHEMBL25802756 0.88 KEAP1 (0.78) KEAP1NFE2L2NOTUM
SCHEMBL24812643 0.88 KEAP1 (0.78) KEAP1NFE2L2NOTUM
SCHEMBL24812743 0.87 KEAP1 (0.87) KEAP1NFE2L2NOTUM
SCHEMBL17599488 0.87 KEAP1 (0.89) KEAP1NFE2L2NOTUMKDM4EALDH1A1

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
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