SCHEMBL4083794

SCHEMBL4083794

O=C1NC(=O)N(C2CC2C2C3CC4CC(C3)CC2C4)C1c1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
ALDH1A1 P00352 7/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 4/20 0.34
GAA P10253 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
HSD17B10 Q99714 2/20 0.34
RAB9A P51151 2/20 0.34
TSHR P16473 1/20 0.34
CASP1 P29466 1/20 0.34
FLT3 P36888 1/20 0.34
CYP3A4 P08684 1/20 0.32
GSK3B P49841 1/20 0.32
HSD11B1 P28845 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
SHMT2 P34897 1/20 0.32
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL27961125 0.64 FLT3 (0.45) DDB1CRBNALDH1A1KDM4ESMN1; SMN2
SCHEMBL75577 0.64 FLT3 (0.39) DDB1CRBNALDH1A1KDM4EHPGD
Bromide SCHEMBL28146019 0.63 FLT3 (0.44) DDB1CRBNALDH1A1KDM4ESMN1; SMN2
SCHEMBL22767893 0.60 OPRM1 (0.45) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL25276477 0.58 DDB1 (0.42) DDB1CRBNALDH1A1KDM4EHPGD
Dipyridyl SCHEMBL28503547 0.58 KDM4E (0.70) ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL2563428 0.58 DDB1 (0.51) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL23745244 0.58 DDB1 (0.51) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL19586070 0.57 CRBN (1.00) DDB1CRBN
SCHEMBL30826030 0.57 CRBN (1.00) 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-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP disclosed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 WO disclosed