SCHEMBL23129059

SCHEMBL23129059

CC1(C)CC(C)(C)C1NC(=O)c1ccc(N2CCC(CN3CCN(c4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)CC3)CC2)nn1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 14/20 0.56
▸ AR P10275 7/20 0.56
▸ ITK Q08881 2/20 0.47
▸ BTK Q06187 4/20 0.46
▸ IRAK1 P51617 1/20 0.46
▸ IRAK4 Q9NWZ3 1/20 0.46
▸ IRAK3 Q9Y616 1/20 0.46
▸ CDK9 P50750 1/20 0.44
▸ EGFR P00533 2/20 0.44
▸ PLK4 O00444 1/20 0.43
▸ HPGDS O60760 1/20 0.42

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
SCHEMBL22661501 0.93 CRBN (0.49) CRBNARITKBTKIRAK1
SCHEMBL23128868 0.91 CRBN (0.56) CRBNARITKBTKIRAK1
SCHEMBL25901300 0.90 CRBN (0.55) CRBNARBTKIRAK1IRAK4
SCHEMBL22661294 0.89 CRBN (0.52) CRBNAR
SCHEMBL23129212 0.89 CRBN (0.60) CRBNARITKBTKIRAK1
SCHEMBL23129204 0.88 CRBN (0.69) CRBNARITKBTKIRAK1
SCHEMBL25900211 0.88 CRBN (0.69) CRBNARITKBTKIRAK1
SCHEMBL29597385 0.86 CRBN (0.55) CRBNARITKBTKIRAK1
SCHEMBL23129276 0.86 CRBN (0.60) CRBNARITKBTKIRAK1
SCHEMBL29058484 0.85 CRBN (0.54) CRBNARITKBTKIRAK1

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-3795570-A1 SUBSTITUTED QUINOLINE-8-CARBONITRILE DERIVATIVES HAVING ANDROGEN RECEPTOR DEGRADATION ACTIVITY AND USES THEREOF Accutar Biotechnology Inc. (US) 2021-03-24 — — EP disclosed
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