SCHEMBL30257111

SCHEMBL30257111

CC(C)(C)OC(=O)N1CCN(C(=O)COc2ccc(N3CCC(=O)NC3=O)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 7/20 0.48
▸ CRBN Q96SW2 7/20 0.48
▸ ALK Q9UM73 1/20 0.45
▸ SIRT3 Q9NTG7 1/20 0.45
▸ MAPK1 P28482 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ TPSAB1 Q15661 1/20 0.43
▸ TPSD1 Q9BZJ3 1/20 0.43
▸ TPSG1 Q9NRR2 1/20 0.43
▸ LIPE Q05469 1/20 0.43
▸ PDE3B Q13370 1/20 0.42
▸ PDE3A Q14432 1/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALDH1A1 P00352 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
SCHEMBL23121408 0.92 GPR119 (0.48) DDB1CRBNLIPE
SCHEMBL30257613 0.89 DDB1 (0.52) DDB1CRBNALKPDE3BPDE3A
SCHEMBL25079570 0.89 DDB1 (0.52) DDB1CRBNALKPDE3BPDE3A
SCHEMBL23142790 0.86 DDB1 (0.48) DDB1CRBN
SCHEMBL31255309 0.85 DDB1 (0.49) DDB1CRBNALKPDE3BPDE3A
SCHEMBL30257619 0.85 DDB1 (0.62) DDB1CRBNLIPEKMT2AMEN1
SCHEMBL22119507 0.83 DDB1 (0.59) DDB1CRBNTSHRKMT2AMEN1
SCHEMBL26266557 0.83 ALDH1A1 (0.58) DDB1CRBNMAPK1TPSAB1TPSD1
SCHEMBL25079332 0.82 TPSAB1 (0.61) DDB1CRBNMAPK1TPSAB1TPSD1
SCHEMBL30501294 0.81 MEN1 (0.55) DDB1CRBNKMT2AMEN1ALDH1A1

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-2023023531-A1 ESTROGEN RECEPTOR DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2023-02-23 — — WO disclosed
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