SCHEMBL25816414

SCHEMBL25816414

Nc1nnc(-c2ccccc2O)cc1N1CCN(Cc2ccc(N3CCC(CN4CCN(c5ccc6c(c5)C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)CC3)c(F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 15/20 0.48
▸ DDB1 Q16531 7/20 0.48
▸ IKZF3 Q9UKT9 7/20 0.48
▸ BTK Q06187 3/20 0.45
▸ CDK9 P50750 1/20 0.42
▸ AR P10275 4/20 0.42
▸ DRD2 P14416 1/20 0.42
▸ ADRA1D P25100 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ ADRA1B P35368 1/20 0.42
▸ EGFR P00533 2/20 0.41
▸ PLK4 O00444 1/20 0.41
▸ IRAK1 P51617 1/20 0.41
▸ IRAK4 Q9NWZ3 1/20 0.41
▸ IRAK3 Q9Y616 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
SCHEMBL25815259 0.90 CRBN (0.43) CRBNDDB1IKZF3BTKDRD2
SCHEMBL25816399 0.83 CRBN (0.45) CRBNDDB1IKZF3BTKCDK9
SCHEMBL23331392 0.82 CRBN (0.49) CRBNBTKCDK9AREGFR
SCHEMBL25816186 0.82 CRBN (0.64) CRBNDDB1IKZF3DRD2ADRA1D
SCHEMBL23134695 0.81 CRBN (0.58) CRBNDDB1IKZF3BTKCDK9
SCHEMBL31331243 0.81 PBRM1 (0.47) CRBNBTK
SCHEMBL23301268 0.81 CRBN (0.45) CRBNBTKCDK9AREGFR
SCHEMBL29942891 0.81 CRBN (0.45) CRBNBTKCDK9AREGFR
SCHEMBL25816369 0.81 PBRM1 (0.56) —
SCHEMBL23134596 0.80 CRBN (0.58) CRBNDDB1IKZF3BTKCDK9

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-2023129506-A1 POTENT AND SELECTIVE SMARCA2 DEGRADING CHIMERIC MOLECULES AS CANCER THERAPEUTICS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-07-06 — — WO disclosed
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