SCHEMBL7422273

SCHEMBL7422273

COc1ccc(CNc2n[nH]cc2C#N)cc1OC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.47
PDE5A O76074 5/20 0.46
PDE1A P54750 1/20 0.46
PDE1B Q01064 1/20 0.46
PDE1C Q14123 1/20 0.46
PDE4B Q07343 9/20 0.44
TPH1 P17752 1/20 0.44
PDE4A P27815 5/20 0.43
PDE4C Q08493 4/20 0.43
PDE4D Q08499 4/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
APP P05067 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
SCHEMBL7471407 0.85 PDE4B (0.50) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL2467226 0.82 RECQL (0.53) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL7418284 0.82 RECQL (0.47) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL7415564 0.80 TPH1 (0.51) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL7937749 0.80 TPH1 (0.51) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL7412528 0.77 TPH1 (0.47) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL13317191 0.77 RECQL (0.61) RECQLPDE4BPDE4APDE4CPDE4D
SCHEMBL7937862 0.76 RECQL (0.52) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL7940449 0.76 RECQL (0.55) RECQLPDE4BTPH1PDE4APDE4C
SCHEMBL27589238 0.74 RECQL (0.50) RECQLPDE4BTPH1PDE4APDE4C

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-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
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 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