SCHEMBL7092998

SCHEMBL7092998

COc1ccc(Cn2c(=O)[nH]c(=O)c3[nH]c(C(C)C)nc32)cc1OC1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.60
PDE4A P27815 16/20 0.60
PDE4C Q08493 16/20 0.60
PDE4D Q08499 16/20 0.60

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
SCHEMBL7089270 0.91 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL6154427 0.91 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL7416418 0.90 PDE4B (0.53) PDE4BPDE4APDE4CPDE4D
SCHEMBL7090590 0.85 PDE4B (0.60) PDE4BPDE4APDE4CPDE4D
SCHEMBL7090584 0.84 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL1388196 0.84 PDE4A (0.60) PDE4BPDE4APDE4CPDE4D
SCHEMBL7020690 0.82 PDE4A (0.60) PDE4BPDE4APDE4CPDE4D
SCHEMBL7423652 0.81 PDE4B (0.52) PDE4BPDE4APDE4CPDE4D
SCHEMBL6155745 0.81 PDE4A (0.79) PDE4BPDE4APDE4CPDE4D
SCHEMBL7738936 0.80 PDE4A (0.58) PDE4BPDE4APDE4CPDE4D

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-0814809-B1 ARYL THIOXANTHINES EURO CELTIQUE SA (LU) 2003-08-13 EP disclosed
US-6440979-B1 Aryl isoguanines EURO-CELTIQUE, S.A. (LU) 2002-08-27 US disclosed
US-6090816-A ANTIASTHMA AGENTS EURO-CELTIQUE S.A. (LU) 2000-07-18 US disclosed
US-6066641-A PHOSPHODIESTERASES AS MOLECULAR TARGETS FOR ANTI-ASTHMATIC AGENTS EURO-CELTIQUE S.A. (LU) 2000-05-23 US disclosed
EP-0814809-A4 ARYL THIOXANTHINES EURO CELTIQUE SA (LU) 1998-04-01 EP disclosed
EP-0814809-A1 ARYL THIOXANTHINES Euroceltique S.A. (LU) 1998-01-07 EP disclosed
WO-1996018399-A1 ARYL THIOXANTHINES EURO-CELTIQUE, S.A. (LU) 1996-06-20 WO disclosed