Sugi Predict

Sugi Predict / Compounds / SCHEMBL23267708

SCHEMBL23267708

SCHEMBL23267708

Cn1c(=O)c(N2CCC2=O)cc2cc(Nc3nc(N4CCN(CC5CCN(c6ccc7c(c6)C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CC4)ncc3Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 7/20 0.48
▸ BTK Q06187 3/20 0.48
▸ AR P10275 3/20 0.44
▸ PTK2 Q05397 1/20 0.44
▸ EGFR P00533 7/20 0.44
▸ PLK4 O00444 2/20 0.44
▸ ALK Q9UM73 2/20 0.43
▸ ERBB2 P04626 1/20 0.43
▸ ERBB3 P21860 1/20 0.42
▸ 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
SCHEMBL31595625 1.00 CRBN (0.48) CRBNBTKARPTK2EGFR
SCHEMBL31595291 0.91 CRBN (0.47) CRBNBTKARPTK2EGFR
SCHEMBL31595686 0.90 PTK2 (0.51) CRBNBTKARPTK2EGFR
SCHEMBL31595323 0.90 CRBN (0.51) CRBNBTKARPTK2EGFR
SCHEMBL23267313 0.89 CRBN (0.49) CRBNBTKARPTK2EGFR
SCHEMBL31595211 0.89 CRBN (0.49) CRBNBTKARPTK2EGFR
SCHEMBL31595190 0.88 CRBN (0.48) CRBNBTKARPTK2EGFR
SCHEMBL23266220 0.88 PTK2 (0.53) CRBNBTKARPTK2
SCHEMBL31595518 0.88 PTK2 (0.53) CRBNBTKARPTK2
SCHEMBL23268167 0.87 PTK2 (0.49) CRBNBTKARPTK2EGFR

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-2021077010-A1 BIFUNCTIONAL MOLECULES CONTAINING AN E3 UBIQUITINE LIGASE BINDING MOIETY LINKED TO A BCL6 TARGETING MOIETY ARVINAS OPERATIONS, INC. (US) 2021-04-22 — — WO disclosed
Send feedback