SCHEMBL29606453

SCHEMBL29606453

COc1ccc(C(=O)N2CCOC3(CCNCC3)C2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CRBN Q96SW2 5/20 0.38
▸ NR3C1 P04150 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ CHRM2 P08172 3/20 0.38
▸ CHRM3 P20309 3/20 0.38
▸ JAK1 P23458 2/20 0.37
▸ EPHX2 P34913 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ NAMPT P43490 2/20 0.36
▸ MAPK1 P28482 2/20 0.35
▸ MLKL Q8NB16 1/20 0.35
▸ PDE4B Q07343 1/20 0.35

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
SCHEMBL23120739 1.00 GLA (0.39) GLAKMT2ACRBNNR3C1PGR
SCHEMBL23121068 0.90 EPHX2 (0.41) GLAKMT2ACRBNNR3C1PGR
SCHEMBL30995363 0.88 CRBN (0.41) CRBNCHRM2CHRM3JAK1EPHX2
SCHEMBL29607702 0.87 JAK1 (0.39) GLAKMT2ACRBNNR3C1PGR
SCHEMBL23121080 0.87 JAK1 (0.39) GLAKMT2ACRBNNR3C1PGR
SCHEMBL21409353 0.85 NR3C1 (0.41) CRBNNR3C1PGRSLC6A4KCNH2
Hydrochloric Acid SCHEMBL31138071 0.84 NR3C1 (0.41) CRBNNR3C1PGRSLC6A4KCNH2
SCHEMBL24735010 0.84 NR3C1 (0.47) GLAKMT2ANR3C1PGRSLC6A4
SCHEMBL29841507 0.84 NR3C1 (0.47) GLAKMT2ANR3C1PGRSLC6A4
SCHEMBL31255399 0.84 CYP3A4 (0.45) NR3C1PGRSLC6A4KCNH2PDE3B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4031247-A1 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE Novartis AG (CH) 2022-07-27 — — EP disclosed
CN-114521196-A Bifunctional group degradation agent and use method thereof 诺华股份有限公司 2022-05-20 — — CN disclosed
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