SCHEMBL30984978

SCHEMBL30984978

Nc1ccc(N2CCC3(CCN(CC4CCN(c5ccc6c(c5)C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)CC3)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 17/20 0.62
▸ DDB1 Q16531 6/20 0.57
▸ AR P10275 4/20 0.52
▸ BTK Q06187 3/20 0.49
▸ CDK9 P50750 1/20 0.47
▸ ITK Q08881 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ CHRM2 P08172 1/20 0.45
▸ OPRM1 P35372 1/20 0.45
▸ IKZF3 Q9UKT9 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ IRAK1 P51617 1/20 0.45
▸ IRAK4 Q9NWZ3 1/20 0.45
▸ IRAK3 Q9Y616 1/20 0.45
▸ ESR1 P03372 1/20 0.44

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
SCHEMBL29986989 0.93 CRBN (0.66) CRBNDDB1ARBTKCDK9
SCHEMBL24299348 0.93 CRBN (0.66) CRBNDDB1ARBTKCDK9
SCHEMBL30984857 0.92 CRBN (0.60) CRBNDDB1ARBTKITK
SCHEMBL30984742 0.91 CRBN (0.61) CRBNDDB1ARBTKCDK9
SCHEMBL30984972 0.89 CRBN (0.60) CRBNDDB1ARBTKCDK9
SCHEMBL30984709 0.89 CRBN (0.59) CRBNDDB1ARBTKCDK9
SCHEMBL30602900 0.89 CRBN (0.65) CRBNDDB1ARBTKALDH1A1
SCHEMBL24481028 0.89 CRBN (0.65) CRBNDDB1ARBTKALDH1A1
SCHEMBL30984751 0.88 CRBN (0.60) CRBNDDB1ARBTKCDK9
SCHEMBL24480592 0.88 CRBN (0.66) CRBNDDB1ARBTKALDH1A1

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 — — WO disclosed
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