SCHEMBL25810298

SCHEMBL25810298

CC(C)(C)OC(=O)N(CCO)Cc1cc(NC(=O)c2cnc(N3CCC(CN4CCNCC4)CC3)cn2)ccc1OCc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.35
BACE1 P56817 6/20 0.34
P2RX3 P56373 1/20 0.34
S1PR1 P21453 1/20 0.33
F10 P00742 1/20 0.33
BACE2 Q9Y5Z0 5/20 0.32
HDAC3 O15379 1/20 0.32
HDAC2 Q92769 1/20 0.32
USP28 Q96RU2 1/20 0.32
USP25 Q9UHP3 1/20 0.32
MCHR1 Q99705 1/20 0.32
MMP13 P45452 1/20 0.31
ABL1 P00519 1/20 0.31
PTK2 Q05397 1/20 0.31

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
SCHEMBL25810296 0.82 USP28 (0.41) BACE1P2RX3BACE2USP28USP25
SCHEMBL25810186 0.70 USP28 (0.45) P2RX3USP28USP25
SCHEMBL25290787 0.68 TP53 (0.34) USP28USP25
SCHEMBL30563485 0.68 TP53 (0.34) USP28USP25
SCHEMBL25423502 0.68 STING1 (0.43) BRAFUSP28USP25ABL1
SCHEMBL30563276 0.68 STING1 (0.43) BRAFUSP28USP25ABL1
SCHEMBL30563296 0.67 USP28 (0.40) USP28USP25
SCHEMBL25809752 0.67 USP28 (0.42) P2RX3USP28USP25
SCHEMBL25810387 0.66 USP28 (0.41) P2RX3USP28USP25
SCHEMBL25810528 0.64 USP28 (0.39) P2RX3USP28USP25

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