SCHEMBL25786459

SCHEMBL25786459

CC(=O)Nc1cccc(CNc2ccc(C(C)C)cn2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.49
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RPS6KB1 P23443 2/20 0.44
CDK2 P24941 2/20 0.44
PLK4 O00444 1/20 0.44
CHEK1 O14757 1/20 0.44
DAPK3 O43293 1/20 0.44
DYRK3 O43781 1/20 0.44
JAK2 O60674 1/20 0.44
ROCK2 O75116 1/20 0.44
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
CHEK2 O96017 1/20 0.44
PRKCG P05129 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
SCHEMBL24729872 0.84 BRAF (0.52) BRAFMEN1KMT2ANPC1ALDH1A1
SCHEMBL20731984 0.83 BRAF (0.51) BRAFMEN1KMT2AALDH1A1RPS6KB1
SCHEMBL23938006 0.79 FABP1 (0.55) BRAFMEN1KMT2ANPC1ALDH1A1
SCHEMBL2261348 0.77 ALDH1A1 (0.57) MEN1KMT2ANPC1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL30874824 0.76 ALDH1A1 (0.56) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL32666863 0.75 PTK2 (0.59) KMT2ANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL5555378 0.75 PTK2 (0.59) KMT2ANPC1MAPTRAB9ASMN1; SMN2
SCHEMBL25068994 0.74 FFAR1 (0.55) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL27428918 0.73 NPSR1 (0.52) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL2991022 0.72 ALDH1A1 (0.58) MEN1KMT2AALDH1A1RAB9ARPS6KB1

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