SCHEMBL2471273

SCHEMBL2471273

CC(C)(C)OC(=O)N1CCC(c2ccc3c(c2)c2ccc(C(=O)N4CCOCC4)cc2n3C(N)=O)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.45
JAK2 O60674 1/20 0.44
GPR119 Q8TDV5 3/20 0.43
SCN9A Q15858 1/20 0.42
LMNA P02545 1/20 0.42
RECQL P46063 1/20 0.41
BTK Q06187 2/20 0.41
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
BRD4 O60885 1/20 0.40
PDE4B Q07343 1/20 0.40
P2RY14 Q15391 1/20 0.39
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
NAMPT P43490 1/20 0.39

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
SCHEMBL2464537 0.87 CNR2 (0.42) CNR2JAK2LMNABRD4
SCHEMBL2467176 0.83 PKM (0.41) CNR2JAK2BRD4
SCHEMBL140627 0.76 JAK2 (0.61) JAK2BTKBRD4
SCHEMBL6132207 0.71 GPR119 (0.67) GPR119PDE4BP2RY14NAMPT
SCHEMBL407152 0.70 GABRG2 (0.47) GPR119PDE4BNAMPT
SCHEMBL22438773 0.70 TLR9 (0.46) JAK2GPR119PDE4BP2RY14NAMPT
SCHEMBL31198802 0.70 ABL1 (0.53) GPR119ABL1RIN1NAMPT
SCHEMBL31111738 0.69 NAMPT (0.56) GPR119PDE4BP2RY14ABL1RIN1
SCHEMBL229512 0.69 NAMPT (0.58) GPR119PDE4BP2RY14ABL1RIN1
SCHEMBL14441102 0.68 NR1H2 (0.55) GPR119LMNAPDE4BABL1RIN1

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-2370407-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2011-10-05 EP disclosed
WO-2010080474-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-07-15 WO disclosed