SCHEMBL24818018

SCHEMBL24818018

O=C(O)CCCOc1cccc2c1CN(C1CCC(=O)NC1=O)C2O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 10/20 0.48
▸ DDB1 Q16531 4/20 0.48
▸ IKZF3 Q9UKT9 3/20 0.47
▸ S1PR5 Q9H228 4/20 0.41
▸ HDAC3 O15379 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ TNF P01375 3/20 0.39
▸ STAT3 P40763 1/20 0.38
▸ MAP1LC3B Q9GZQ8 1/20 0.38
▸ IL1B P01584 1/20 0.38

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
SCHEMBL22857769 0.87 CRBN (0.46) CRBNDDB1IKZF3HDAC3HDAC1
SCHEMBL21906782 0.82 CRBN (0.46) CRBNDDB1IKZF3HDAC3HDAC1
SCHEMBL20759933 0.81 CRBN (0.45) CRBNDDB1IKZF3TNFIL1B
SCHEMBL21897792 0.81 CRBN (0.46) CRBNDDB1IKZF3
SCHEMBL22959814 0.81 S1PR5 (0.40) S1PR5
SCHEMBL19709449 0.81 CRBN (0.52) CRBNDDB1IKZF3HDAC3HDAC1
SCHEMBL19541974 0.81 CRBN (0.49) CRBNDDB1IKZF3HDAC3HDAC1
SCHEMBL22243534 0.81 CRBN (0.56) CRBNDDB1IKZF3HDAC3HDAC1
SCHEMBL24123477 0.80 CRBN (0.71) CRBNDDB1IKZF3HDAC3HDAC1
SCHEMBL20990626 0.79 CRBN (0.42) CRBNDDB1IKZF3HDAC3HDAC1

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-2022268229-A1 PROTEIN INHIBITOR OR DEGRADING AGENT, PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PHARMACEUTICAL USE 和径医药科技(上海)有限公司 2022-12-29 — — WO disclosed
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