SCHEMBL26133203

SCHEMBL26133203

O=CC(=O)C1CCC(N2Cc3c(ccc(N4CC5CCC4CN5)c3F)C2=O)CN1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.36
▸ CHRNB2 P17787 1/20 0.33
▸ CHRNA4 P43681 1/20 0.33
▸ IKZF2 Q9UKS7 1/20 0.32
▸ IRAK4 Q9NWZ3 4/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ CRBN Q96SW2 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
SCHEMBL26132556 0.94 MAPK1 (0.35) MAPK1CHRNB2CHRNA4IKZF2
SCHEMBL26133128 0.89 MAPK1 (0.33) MAPK1
SCHEMBL26133400 0.88 MAPK1 (0.38) MAPK1CHRNB2CHRNA4IRAK4HDAC1
SCHEMBL26132546 0.87 MAPK1 (0.33) MAPK1
SCHEMBL26094442 0.86 MAPK1 (0.33) MAPK1CHRNB2CHRNA4HDAC1
SCHEMBL26133806 0.86 MAPK1 (0.31) MAPK1CHRNB2CHRNA4
SCHEMBL26133803 0.85 MAPK1 (0.34) MAPK1
SCHEMBL26090922 0.85 HDAC1 (0.30) HDAC1
SCHEMBL26133327 0.85 CHRNB2 (0.33) MAPK1CHRNB2CHRNA4HDAC1
SCHEMBL26133268 0.84 MAPK1 (0.33) MAPK1

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-2023066350-A1 CRBN E3 LIGASE LIGAND COMPOUND, PROTEIN DEGRADING AGENT DEVELOPED ON THE BASIS OF LIGAND COMPOUND, AND THEIR APPLICATIONS 标新生物医药科技(上海)有限公司 2023-04-27 — — WO claimed
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