SCHEMBL22566049

SCHEMBL22566049

O=C1CCC(N2C(=O)c3cc(F)c(N4CCN(C5CCC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.75
▸ DDB1 Q16531 10/20 0.54
▸ IKZF3 Q9UKT9 3/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ OPRM1 P35372 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ TNF P01375 2/20 0.45
▸ IKZF1 Q13422 2/20 0.45
▸ IL1B P01584 1/20 0.45
▸ TBXA2R P21731 1/20 0.45
▸ IKZF2 Q9UKS7 1/20 0.45

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
SCHEMBL22565044 0.97 CRBN (0.74) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL26480838 0.91 CRBN (0.65) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL26111363 0.88 CRBN (0.79) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL30606686 0.87 CRBN (0.66) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31586405 0.86 CRBN (0.67) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL23152112 0.86 CRBN (0.77) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22565244 0.86 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29330488 0.86 CRBN (0.80) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22557468 0.85 CRBN (0.79) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31583413 0.85 CRBN (0.66) CRBNDDB1IKZF3ALDH1A1CHRM2

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-2020211822-A1 A CLASS OF BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUNDS FOR TARGETED DEGRADATION OF ANDROGEN RECEPTORS AND USE THEREOF 成都海创药业有限公司 2020-10-22 — — WO disclosed
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