SCHEMBL25809920

SCHEMBL25809920

CCCSc1nc(NCCNC(=O)OC(C)(C)C)c2nnn(Cc3ccccc3)c2n1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ USP28 Q96RU2 1/20 0.58
▸ KDM1A O60341 2/20 0.49
▸ KMT2A Q03164 2/20 0.47
▸ BRD4 O60885 1/20 0.44
▸ MEN1 O00255 1/20 0.44

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
SCHEMBL25808446 0.93 USP28 (0.58) USP28KDM1AKMT2ABRD4
SCHEMBL25809850 0.92 USP28 (0.69) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25808447 0.92 USP28 (0.59) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25808401 0.92 USP28 (0.59) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25794117 0.90 USP28 (0.59) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25808485 0.90 USP28 (0.56) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25813861 0.90 USP28 (0.56) USP28KDM1AKMT2ABRD4
SCHEMBL25808402 0.89 USP28 (0.54) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25808487 0.87 USP28 (0.57) USP28KDM1AKMT2ABRD4MEN1
SCHEMBL25795474 0.84 USP28 (0.68) USP28KDM1AKMT2AMEN1

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
Send feedback