SCHEMBL31477181

SCHEMBL31477181

CC(C(N)=O)c1cccc(-c2cnoc2)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 10/20 0.39
PSEN2 P49810 10/20 0.39
APH1B Q8WW43 10/20 0.39
NCSTN Q92542 10/20 0.39
APH1A Q96BI3 10/20 0.39
PSENEN Q9NZ42 10/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
MAPK1 P28482 1/20 0.37
APP P05067 1/20 0.36
BRD4 O60885 1/20 0.35
BRD2 P25440 1/20 0.35
CREBBP Q92793 1/20 0.35
FTO Q9C0B1 1/20 0.35
EPHX1 P07099 1/20 0.35

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
SCHEMBL31422555 0.87 PTGS2 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27480602 0.79 RXRA (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30353435 0.79 RXRA (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2183673 0.78 CTSK (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2183876 0.74 PSEN1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3433216 0.72 PSEN1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4266768 0.71 KEAP1 (0.51) APP
SCHEMBL27705864 0.71 KEAP1 (0.51) APP
SCHEMBL27705669 0.71 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4260357 0.71 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A

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-2025085564-A1 LYSINE ACETYLTRANSFERASE INHIBITORS Kronos Bio, Inc. (US) 2025-04-24 WO disclosed