SCHEMBL22047521

SCHEMBL22047521

O=C1CCC(N2C(=O)c3cc(F)c(N4CC[C@@H](CO)C4)cc3C2O)C(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 17/20 0.47
▸ DDB1 Q16531 7/20 0.37
▸ TNF P01375 1/20 0.36
▸ IKZF1 Q13422 1/20 0.35
▸ IKZF2 Q9UKS7 1/20 0.35
▸ IKZF3 Q9UKT9 5/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ AR P10275 1/20 0.34
▸ DRD2 P14416 1/20 0.33
▸ ADRA1D P25100 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ ADRA1B P35368 1/20 0.33

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
SCHEMBL26754973 0.89 CRBN (0.43) CRBNDDB1TNFIKZF1IKZF2
SCHEMBL22873401 0.86 CRBN (0.53) CRBNDDB1TNFIKZF1IKZF2
SCHEMBL20046347 0.84 CRBN (0.66) CRBNDDB1TNFIKZF3ALDH1A1
SCHEMBL25059028 0.84 CRBN (0.56) CRBNDDB1IKZF1IKZF2IKZF3
SCHEMBL20076201 0.82 CRBN (0.53) CRBNDDB1TNFIKZF3ALDH1A1
SCHEMBL22565934 0.82 CRBN (0.47) CRBNDDB1TNFIKZF1IKZF2
SCHEMBL23138921 0.81 CRBN (0.47) CRBNDDB1TNFIKZF3ALDH1A1
SCHEMBL22565718 0.80 CRBN (0.50) CRBNDDB1TNFIKZF3ALDH1A1
SCHEMBL25133215 0.80 CRBN (0.51) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL30985067 0.80 CRBN (0.51) CRBNDDB1TNFIKZF1IKZF3

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-3660004-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas Operations, Inc. (US) 2020-06-03 — — EP disclosed
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