SCHEMBL6170153

SCHEMBL6170153

COC(=O)CCCCCOc1ccc2nc(S(=O)(=O)C(C)C)n(-c3ccc(C)cc3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 9/20 0.46
PDE3A Q14432 9/20 0.46
P2RY12 Q9H244 7/20 0.46
PDE2A O00408 3/20 0.46
DPP4 P27487 5/20 0.38
DYRK1A Q13627 3/20 0.38
AR P10275 1/20 0.37
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL6168443 0.92 PDE3B (0.46) PDE3BPDE3AP2RY12PDE2APPARG
SCHEMBL6167194 0.91 DPP4 (0.47) PDE3BPDE3AP2RY12PDE2ADPP4
SCHEMBL5414898 0.87 PDE3B (0.45) PDE3BPDE3AP2RY12PDE2ADYRK1A
SCHEMBL5408087 0.86 PDE3B (0.44) PDE3BPDE3AP2RY12PDE2ADYRK1A
SCHEMBL5412443 0.84 PDE3B (0.43) PDE3BPDE3AP2RY12PDE2ADPP4
SCHEMBL6168820 0.83 PDE3B (0.45) PDE3BPDE3AP2RY12PDE2ADPP4
SCHEMBL5421328 0.83 PDE3B (0.50) PDE3BPDE3AP2RY12PDE2ADPP4
SCHEMBL5412794 0.83 PDE3B (0.50) PDE3BPDE3AP2RY12PDE2ADPP4
SCHEMBL5420170 0.81 PDE3B (0.45) PDE3BPDE3AP2RY12PDE2ADPP4
SCHEMBL2330018 0.81 PDE3B (0.48) PDE3BPDE3AP2RY12PDE2AAR

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-1404656-B9 BENZIMIDAZOLE DERIVATIVES FOR TREATING MICROGLIA-ACTIVATION ASSOCIATED DISEASES SUCH AS INFLAMMATORY, ALLERGIC, INFECTIOUS OR AUTOIMMUNE DISEASES SCHERING AG (DE) 2005-10-19 EP claimed
EP-1404656-B1 BENZIMIDAZOLE DERIVATIVES FOR TREATING MICROGLIA-ACTIVATION ASSOCIATED DISEASES SUCH AS INFLAMMATORY, ALLERGIC, INFECTIOUS OR AUTOIMMUNE DISEASES SCHERING AG (DE) 2005-05-18 EP claimed