SCHEMBL7170246

SCHEMBL7170246

CCOc1cc(C2(C)CCC(=O)O2)ccc1OC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.53
PDE4D Q08499 7/20 0.53
PDE4A P27815 8/20 0.43
PDE4C Q08493 6/20 0.43
KMT2A Q03164 1/20 0.40
DYRK1A Q13627 1/20 0.40
PDE3A Q14432 1/20 0.40
LMNA P02545 1/20 0.39
ALDH1A1 P00352 4/20 0.39
MAPK1 P28482 2/20 0.39
POLB P06746 1/20 0.39
GFER P55789 1/20 0.39
HPGD P15428 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
GAA P10253 1/20 0.37
CASP1 P29466 1/20 0.37
IGF1R P08069 1/20 0.37

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
SCHEMBL7170243 1.00 PDE4B (0.53) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL7177909 0.90 PDE4B (0.66) PDE4BPDE4DPDE4APDE4CLMNA
SCHEMBL7174936 0.90 PDE4B (0.66) PDE4BPDE4DPDE4APDE4CLMNA
SCHEMBL7175061 0.90 PDE4B (0.66) PDE4BPDE4DPDE4APDE4CLMNA
SCHEMBL7172429 0.89 LMNA (0.48) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL7172425 0.89 LMNA (0.48) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL7170264 0.86 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL7170196 0.86 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL7171526 0.86 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL7170248 0.85 PDE4B (0.48) PDE4BPDE4DPDE4APDE4C

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0900212-B1 CHIRAL PHENYLDIHYDROFURANONES AS PDE-IV INHIBITORS SCHERING AG (DE) 2003-12-17 EP claimed
US-6011060-A TREATING A DISEASE MEDIATED BY ACTIVATION OF THE TUMOR NECROSIS FACTOR SCHERING AKTIENGESELLSCHAFT (DE) 2000-01-04 US claimed
EP-0900212-B1 CHIRAL PHENYLDIHYDROFURANONES AS PDE-IV INHIBITORS SCHERING AG (DE) 2003-12-17 EP disclosed
US-6011060-A TREATING A DISEASE MEDIATED BY ACTIVATION OF THE TUMOR NECROSIS FACTOR SCHERING AKTIENGESELLSCHAFT (DE) 2000-01-04 US disclosed
EP-0900212-A1 CHIRAL PHENYLDIHYDROFURANONES AS PDE-IV INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1999-03-10 EP disclosed
WO-1997040032-A1 CHIRAL PHENYLDIHYDROFURANONES AS PDE-IV INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1997-10-30 WO disclosed