SCHEMBL7440108

SCHEMBL7440108

COc1ccc(-c2ccc(C(N)=O)cc2)cc1OC1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 12/20 1.00
PDE4D Q08499 12/20 1.00
PDE4A P27815 12/20 1.00
PDE4C Q08493 11/20 1.00
MAPK14 Q16539 1/20 0.60
POLB P06746 1/20 0.56

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
SCHEMBL7444846 0.89 PDE4A (1.00) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL8885266 0.89 PDE4B (0.81) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL4728938 0.89 PDE4B (0.80) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL7435711 0.88 PDE4A (0.82) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL7501628 0.88 PDE4A (0.97) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL8461881 0.88 PDE4A (0.79) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL7447872 0.87 PDE4B (0.77) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL7501633 0.87 PDE4A (0.77) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL7451207 0.86 PDE4A (0.79) PDE4BPDE4DPDE4APDE4C
SCHEMBL8466031 0.86 PDE4A (0.75) PDE4BPDE4DPDE4APDE4CPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745063-B1 SUBSTITUTED BIPHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS AMERICAN HOME PROD (US) 1999-03-24 EP claimed
US-5691376-A ANTIHISTAMINE, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-11-25 US claimed
EP-0745063-A1 SUBSTITUTED BIPHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-12-04 EP claimed
WO-1995022520-A1 SUBSTITUTED BIPHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1995-08-24 WO claimed
EP-0745063-B1 SUBSTITUTED BIPHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS AMERICAN HOME PROD (US) 1999-03-24 EP disclosed
US-5691376-A ANTIHISTAMINE, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-11-25 US disclosed
US-5650444-A BRONCHODILATOR AGENTS, ANTIALLERGENS AND ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-07-22 US disclosed