SCHEMBL29821987

SCHEMBL29821987

Nc1ccc(N2CCC(CCN3CCN(c4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)CC3)CC2)nc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 13/20 0.56
▸ DDB1 Q16531 2/20 0.52
▸ BTK Q06187 4/20 0.51
▸ CCNC P24863 1/20 0.48
▸ CDK8 P49336 1/20 0.48
▸ IRAK1 P51617 1/20 0.48
▸ NTRK3 Q16288 1/20 0.48
▸ HASPIN Q8TF76 1/20 0.48
▸ CDK19 Q9BWU1 1/20 0.48
▸ IRAK4 Q9NWZ3 1/20 0.48
▸ IRAK3 Q9Y616 1/20 0.48
▸ AR P10275 1/20 0.46
▸ HPGDS O60760 2/20 0.46
▸ EGFR P00533 3/20 0.46
▸ IL2 P60568 1/20 0.46
▸ ITK Q08881 1/20 0.46
▸ RAF1 P04049 2/20 0.45
▸ ESR1 P03372 2/20 0.44
▸ ERBB2 P04626 1/20 0.43

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
SCHEMBL23117846 1.00 CRBN (0.56) CRBNDDB1BTKCCNCCDK8
SCHEMBL29822185 0.92 CRBN (0.58) CRBNDDB1BTKIRAK1IRAK4
SCHEMBL23117898 0.92 CRBN (0.58) CRBNDDB1BTKIRAK1IRAK4
SCHEMBL27098821 0.91 CRBN (0.56) CRBNDDB1BTKCCNCCDK8
SCHEMBL23134577 0.91 CRBN (0.58) CRBNDDB1BTKCCNCCDK8
SCHEMBL23133938 0.90 CRBN (0.69) CRBNDDB1BTKHPGDS
SCHEMBL29821993 0.88 CRBN (0.54) CRBNDDB1BTKCCNCCDK8
SCHEMBL23172624 0.88 CRBN (0.53) CRBNDDB1BTKCCNCCDK8
SCHEMBL23117865 0.88 CRBN (0.54) CRBNDDB1BTKCCNCCDK8
SCHEMBL27099030 0.85 CRBN (0.57) CRBNDDB1BTKCCNCCDK8

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
EP-4034114-A1 NOVEL UREAS HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF Accutar Biotechnology Inc. (US) 2022-08-03 — — EP disclosed
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