SCHEMBL29538073

SCHEMBL29538073

CC(C)(C)OC(=O)N1CC[C@H](c2ccc(Nc3ccccc3)nc2)C1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.56
CRBN Q96SW2 1/20 0.56
HPGDS O60760 3/20 0.51
USP30 Q70CQ3 1/20 0.49
NAMPT P43490 1/20 0.49
WNT3A P56704 1/20 0.49
PDE4B Q07343 1/20 0.48
JAK2 O60674 3/20 0.47
JAK1 P23458 3/20 0.47
TP53 P04637 3/20 0.47
GPR119 Q8TDV5 2/20 0.47
LMNA P02545 1/20 0.47
GRM5 P41594 1/20 0.46
MAPT P10636 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
SCHEMBL27702405 0.86 DDB1 (0.61) DDB1CRBNHPGDSUSP30NAMPT
SCHEMBL20281909 0.80 PDE4B (0.54) DDB1CRBNHPGDSUSP30NAMPT
SCHEMBL22608993 0.80 PDE4B (0.54) DDB1CRBNHPGDSUSP30NAMPT
SCHEMBL665957 0.80 DDB1 (0.57) DDB1CRBNNAMPTWNT3AJAK2
SCHEMBL23951735 0.80 TP53 (0.59) HPGDSUSP30NAMPTPDE4BJAK2
SCHEMBL697513 0.80 TP53 (0.59) HPGDSUSP30NAMPTPDE4BJAK2
SCHEMBL1751432 0.80 TP53 (0.59) HPGDSUSP30NAMPTPDE4BJAK2
SCHEMBL1989165 0.80 NAMPT (0.65) USP30NAMPTPDE4BTP53GPR119
SCHEMBL1989164 0.80 NAMPT (0.65) USP30NAMPTPDE4BTP53GPR119
SCHEMBL610356 0.79 PDE4B (0.53) DDB1CRBNHPGDSUSP30NAMPT

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-3187490-B1 SUBSTITUTED BENZAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2022-04-06 EP disclosed