SCHEMBL7676935

SCHEMBL7676935

COc1ccc(Cn2c(=O)[nH]c(=S)c3[nH]cnc32)cc1OC1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 19/20 0.48
PDE4A P27815 16/20 0.46
PDE4C Q08493 16/20 0.46
PDE4D Q08499 16/20 0.46
PNP P00491 1/20 0.41

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
SCHEMBL7336596 0.91 PDE4B (0.47) PDE4BPDE4APDE4CPDE4D
SCHEMBL7337524 0.87 MPO (0.55) PDE4BPDE4APDE4CPDE4D
SCHEMBL8655603 0.85 PDE4B (0.48) PDE4BPDE4APDE4CPDE4D
SCHEMBL7089270 0.83 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL7335045 0.79 PDE4B (0.47) PDE4BPDE4APDE4CPDE4D
SCHEMBL7738930 0.79 PDE4B (0.45) PDE4BPDE4APDE4CPDE4D
SCHEMBL6675074 0.79 PDE4B (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL7683789 0.77 PDE4B (0.45) PDE4BPDE4APDE4CPDE4D
SCHEMBL7093510 0.77 MTNR1A (0.56) PDE4BPDE4APDE4CPDE4D
SCHEMBL7092998 0.76 PDE4B (0.60) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6066641-A PHOSPHODIESTERASES AS MOLECULAR TARGETS FOR ANTI-ASTHMATIC AGENTS EURO-CELTIQUE S.A. (LU) 2000-05-23 US claimed
EP-0814809-A4 ARYL THIOXANTHINES EURO CELTIQUE SA (LU) 1998-04-01 EP claimed
EP-0814809-A1 ARYL THIOXANTHINES Euroceltique S.A. (LU) 1998-01-07 EP claimed
WO-1996018399-A1 ARYL THIOXANTHINES EURO-CELTIQUE, S.A. (LU) 1996-06-20 WO claimed
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