SCHEMBL22119482

SCHEMBL22119482

O=C1C[C@H](Nc2cccc(C3CCN(C(=O)O)CC3)c2)C(=O)N1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 9/20 0.44
CRBN Q96SW2 9/20 0.44
NPC1 O15118 2/20 0.43
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 2/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PARP14 Q460N5 1/20 0.38
BTK Q06187 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
IDO1 P14902 1/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL22119641 0.86 TSHR (0.50) DDB1CRBNNPC1GAATSHR
SCHEMBL28629401 0.85 DDB1 (0.58) DDB1CRBNNPC1RAB9AMAPT
SCHEMBL22119499 0.85 DDB1 (0.58) DDB1CRBNNPC1RAB9AMAPT
SCHEMBL22144678 0.85 DDB1 (0.47) DDB1CRBNGAATSHR
SCHEMBL27363599 0.78 DDB1 (0.58) DDB1CRBN
SCHEMBL23538658 0.77 DDB1 (0.69) DDB1CRBNMAPT
SCHEMBL31447706 0.77 DDB1 (0.53) DDB1CRBN
SCHEMBL23551338 0.76 DDB1 (0.59) DDB1CRBNDRD2DRD4DRD3
SCHEMBL31323798 0.76 DDB1 (0.59) DDB1CRBNDRD2DRD4DRD3
SCHEMBL23539324 0.75 DDB1 (0.59) DDB1CRBN

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-3897631-A1 TARGETED PROTEIN DEGRADATION C4 Therapeutics, Inc. (US) 2021-10-27 EP disclosed
WO-2020132561-A1 TARGETED PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2020-06-25 WO disclosed