SCHEMBL1387380

SCHEMBL1387380

COc1ccc(C(Cc2ccncc2)c2ccncc2)cc1OC1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 19/20 1.00
PDE4D Q08499 2/20 0.91
PDE4B Q07343 1/20 0.91
PDE4C Q08493 1/20 0.91

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
SCHEMBL1387378 1.00 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL1387472 1.00 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL6755361 0.98 PDE4A (0.95) PDE4APDE4DPDE4BPDE4C
Cdp840 SCHEMBL84490 0.95 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
Cdp840 SCHEMBL29412448 0.95 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
Cdp840 SCHEMBL1389110 0.95 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
Cdp840 SCHEMBL153739 0.95 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL6251077 0.95 PDE4A (0.92) PDE4APDE4DPDE4BPDE4C
Cdp840 SCHEMBL29351573 0.95 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL6861670 0.94 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3581713-B2 2004-10-27 JP claimed
EP-0626939-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2001-11-07 EP claimed
JP-H09510691-A 1997-10-28 JP claimed
US-5622977-A ANTIINFLAMMATORY AGENT, ANTIALLERGENS CELLTECH THERAPEUTICS LIMITED (GB) 1997-04-22 US claimed
EP-0736010-A1 AN ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF CHIRAL TRIARYL DERIVATIVES AND CHIRAL INTERMEDIATES FOR USE THEREIN CELLTECH THERAPEUTICS LIMITED (GB) 1996-10-09 EP claimed
WO-1995017386-A1 AN ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF CHIRAL TRIARYL DERIVATIVES AND CHIRAL INTERMEDIATES FOR USE THEREIN CELLTECH THERAPEUTICS LIMITED (GB) 1995-06-29 WO claimed
EP-0626939-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1994-12-07 EP claimed
WO-1994014742-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH LIMITED (GB) 1994-07-07 WO claimed
EP-0626939-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2001-11-07 EP disclosed
US-5622977-A ANTIINFLAMMATORY AGENT, ANTIALLERGENS CELLTECH THERAPEUTICS LIMITED (GB) 1997-04-22 US disclosed
US-5608070-A ENZYME INHIBITOR; ANTIINFLAMMATORY, BRONCHODILATOR AGENTS CELLTECH THERAPEUTICS LIMITED (GB) 1997-03-04 US disclosed
EP-0736010-A1 AN ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF CHIRAL TRIARYL DERIVATIVES AND CHIRAL INTERMEDIATES FOR USE THEREIN CELLTECH THERAPEUTICS LIMITED (GB) 1996-10-09 EP disclosed
WO-1995017386-A1 AN ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF CHIRAL TRIARYL DERIVATIVES AND CHIRAL INTERMEDIATES FOR USE THEREIN CELLTECH THERAPEUTICS LIMITED (GB) 1995-06-29 WO disclosed
EP-0626939-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1994-12-07 EP disclosed
WO-1994014742-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH LIMITED (GB) 1994-07-07 WO disclosed