SCHEMBL22694946

SCHEMBL22694946

CNC(=O)CCC(C=O)N1Cc2c(OCc3ccc(CN4CCOCC4)cc3)cccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 11/20 0.49
▸ IKZF3 Q9UKT9 10/20 0.49
▸ TNF P01375 5/20 0.49
▸ IL1B P01584 3/20 0.49
▸ IKZF1 Q13422 1/20 0.49
▸ DDB1 Q16531 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL20880770 0.89 CRBN (0.54) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL20169760 0.86 CRBN (0.53) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL19222305 0.86 CRBN (0.42) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL18975490 0.85 CRBN (0.51) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL24243428 0.83 CRBN (0.49) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL19222087 0.83 CRBN (0.49) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL20459068 0.82 CRBN (0.51) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL20879678 0.82 LMNA (0.41) ALDH1A1SMN1; SMN2LMNAMAPTHTT
SCHEMBL19171822 0.81 CRBN (0.57) CRBNIKZF3TNFIL1BIKZF1
SCHEMBL24137895 0.80 CRBN (0.49) CRBNIKZF3TNFIL1BIKZF1

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-3741372-A1 (S)-3-[4-(4-MORPHLIN-4-YLMETHYLBENZYLOXY)-1- OXO-1,3-DIHYDRO-ISOINDO-2-YL]PIPERIDINE-2,6-DIONE FOR USE IN THE TREATMENT OF IMMUNE-RELATED AND INFLAMMATORY DISEASES Celgene Corporation (US) 2020-11-25 — — EP disclosed
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