SCHEMBL25804358

SCHEMBL25804358

O=C(Nc1ccc(OCc2ccc(F)c(C(F)(F)F)c2)c(CNCCO)c1)c1cnc(N2CCC(CN3CCN(C(=O)NCCCCCN4CCN(CC(O)Cn5c6ccc(Br)cc6c6cc(Br)ccc65)CC4)CC3)CC2)cn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP28 Q96RU2 1/20 0.40
USP25 Q9UHP3 1/20 0.40
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
FPR3 P25089 1/20 0.30
FPR2 P25090 1/20 0.30
CHRM2 P08172 1/20 0.30

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
SCHEMBL30563296 1.00 USP28 (0.40) USP28USP25DRD2DRD3FPR3
SCHEMBL30563385 0.77 USP28 (0.59) USP28USP25
SCHEMBL25804299 0.77 USP28 (0.59) USP28USP25
SCHEMBL25290787 0.77 TP53 (0.34) USP28USP25
SCHEMBL30563485 0.77 TP53 (0.34) USP28USP25
SCHEMBL25247189 0.73 TP53 (0.33) USP28USP25
SCHEMBL30563343 0.73 TP53 (0.33) USP28USP25
SCHEMBL25804293 0.72 USP28 (0.56) USP28USP25
SCHEMBL30563364 0.72 USP28 (0.56) USP28USP25
SCHEMBL30563276 0.70 STING1 (0.43) USP28USP25

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