SCHEMBL24031374

SCHEMBL24031374

CC1(C)CC(C)(C)C1NC(=O)c1ccc(N2CCC(CN3Cc4cc5c(cc4C3)C(=O)N(C3CCC(=O)NC3=O)C5=O)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 17/20 0.59
▸ AR P10275 7/20 0.59
▸ DDB1 Q16531 2/20 0.44
▸ BTK Q06187 1/20 0.43
▸ BRD9 Q9H8M2 1/20 0.42
▸ ITK Q08881 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ EGFR P00533 1/20 0.41

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
SCHEMBL24031859 0.91 CRBN (0.49) CRBNARDDB1BRD9
SCHEMBL24031759 0.90 CRBN (0.49) CRBNARDDB1ESR1
SCHEMBL23129204 0.90 CRBN (0.69) CRBNARDDB1BTKITK
SCHEMBL25900211 0.90 CRBN (0.69) CRBNARDDB1BTKITK
SCHEMBL24031726 0.89 CRBN (0.54) CRBNARDDB1BTKBRD9
SCHEMBL26808203 0.88 CRBN (0.54) CRBNARDDB1BTKESR1
SCHEMBL26808846 0.88 CRBN (0.54) CRBNARDDB1BTKESR1
SCHEMBL26816393 0.88 CRBN (0.54) CRBNARDDB1ITKEGFR
SCHEMBL24031399 0.88 CRBN (0.54) CRBNARDDB1BTKESR1
SCHEMBL23129206 0.87 CRBN (0.59) CRBNARDDB1ITKEGFR

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-2021231927-A1 ANDROGEN RECEPTOR PROTEIN DEGRADERS WITH A TRICYCLIC CEREBLON LIGAND THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-11-18 — — WO disclosed
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