SCHEMBL25524508

SCHEMBL25524508

CNc1cccc2c1CN(C1CCC(=O)NC1)C2=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 10/20 0.47
▸ BRD4 O60885 2/20 0.42
▸ IKZF3 Q9UKT9 2/20 0.42
▸ IKZF1 Q13422 2/20 0.42
▸ TNF P01375 1/20 0.42
▸ IL1B P01584 1/20 0.42
▸ DDB1 Q16531 1/20 0.42
▸ MAP1LC3B Q9GZQ8 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTR2B P41595 5/20 0.36
▸ IDH1 O75874 1/20 0.36
▸ HTR2A P28223 3/20 0.36
▸ HTR2C P28335 3/20 0.36
▸ CDK4 P11802 1/20 0.36
▸ CSNK1A1 P48729 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
SCHEMBL23959034 0.87 CRBN (0.46) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL25671252 0.86 CRBN (0.47) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL21311550 0.84 CRBN (0.49) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL23418261 0.84 CRBN (0.41) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL28602539 0.82 CRBN (0.45) CRBNBRD4MAP1LC3B
SCHEMBL21480839 0.81 CRBN (0.62) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL27097876 0.81 CRBN (0.62) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL22733298 0.81 CRBN (0.49) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL20652629 0.81 HTR2B (0.53) CRBNBRD4IKZF3IKZF1TNF
SCHEMBL23319245 0.81 CRBN (0.47) CRBNBRD4IKZF3IKZF1TNF

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-2023078813-A1 HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS MERCK PATENT GMBH (DE) 2023-05-11 — — WO disclosed
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