SCHEMBL7420665

SCHEMBL7420665

COc1ccc(CCc2n[nH]cc2CO)cc1OC1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.48
RECQL P46063 1/20 0.46
PDE4A P27815 12/20 0.44
PDE4C Q08493 6/20 0.44
PDE4D Q08499 6/20 0.44
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL2467226 0.82 RECQL (0.53) PDE4BRECQLPDE4APDE4CPDE4D
SCHEMBL7418182 0.80 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DHDAC1
SCHEMBL5610571 0.78 RECQL (0.61) PDE4BRECQLPDE4APDE4CPDE4D
SCHEMBL2958828 0.78 RECQL (0.60) PDE4BRECQLPDE4APDE4CPDE4D
Methyl Alcohol SCHEMBL7418694 0.76 PDE4B (0.53) PDE4BRECQLPDE4APDE4CPDE4D
SCHEMBL7324666 0.76 RECQL (0.58) PDE4BRECQLPDE4APDE4CPDE4D
SCHEMBL6571638 0.76 POLB (0.50) PDE4BRECQLPDE4APDE4CPDE4D
SCHEMBL7420478 0.75 PDE4B (0.48) PDE4BPDE4APDE4CPDE4D
SCHEMBL7420475 0.75 PDE4B (0.47) PDE4BPDE4APDE4CPDE4D
SCHEMBL6889304 0.75 PDE4A (0.63) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922751-A BRONCHODILATOR AND ANTIINFLAMMATORY AGENT WITHOUT UNDESIRABLE CARDIOVASCULAR STIMULATION CAUSED BY PHOSPHODIESTERASE III INHIBITOR EURO-CELTIQUE, S.A. (LU) 1999-07-13 US claimed
US-6248769-B1 ANTIINFLAMMATORY AGENT EURO-CELTIQUE S.A. (LU) 2001-06-19 US disclosed
US-6103749-A PHENYL IMIDAZOLE COMPOUNDS USEFUL FOR TREATMENT OF ASTHMA, ALLERGIES, INFLAMMATION AND DEPRESSION EURO-CELTIQUE S.A. (LU) 2000-08-15 US disclosed
EP-0766676-A4 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV EURO CELTIQUE SA (LU) 1998-07-08 EP disclosed
EP-0766676-A1 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV Euroceltique S.A. (LU) 1997-04-09 EP disclosed
WO-1996000218-A1 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV EURO-CELTIQUE, S.A. (LU) 1996-01-04 WO disclosed