SCHEMBL29822127

SCHEMBL29822127

O=C1CCC(N2C(=O)c3ccc(N4CCN(CC5CCN(c6ccc([N+](=O)[O-])cn6)CC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 11/20 0.57
▸ DDB1 Q16531 1/20 0.57
▸ AR P10275 4/20 0.50
▸ BTK Q06187 3/20 0.49
▸ PLK4 O00444 2/20 0.46
▸ EGFR P00533 2/20 0.46
▸ IRAK1 P51617 1/20 0.46
▸ IRAK4 Q9NWZ3 1/20 0.46
▸ IRAK3 Q9Y616 1/20 0.46
▸ CDK9 P50750 1/20 0.45
▸ ITK Q08881 1/20 0.45
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ HPGDS O60760 1/20 0.43
▸ ALK Q9UM73 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
SCHEMBL23117907 1.00 CRBN (0.57) CRBNDDB1ARBTKPLK4
SCHEMBL29821993 0.93 CRBN (0.54) CRBNDDB1ARBTKEGFR
SCHEMBL23117865 0.93 CRBN (0.54) CRBNDDB1ARBTKEGFR
SCHEMBL25690999 0.93 CRBN (0.66) CRBNDDB1BTKMEN1KMT2A
SCHEMBL25691416 0.92 CRBN (0.47) CRBNDDB1ARBTKPLK4
SCHEMBL23117832 0.91 CRBN (0.57) CRBNDDB1ARBTKPLK4
SCHEMBL23117898 0.88 CRBN (0.58) CRBNDDB1ARBTKPLK4
SCHEMBL29822185 0.88 CRBN (0.58) CRBNDDB1ARBTKPLK4
SCHEMBL25691074 0.88 CRBN (0.54) CRBNDDB1ARBTKPLK4
SCHEMBL29821966 0.87 CRBN (0.55) CRBNDDB1

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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