SCHEMBL7746240

SCHEMBL7746240

COC(=O)c1ccc2cc(OC)c(OC)cc2c1-c1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP46A1 Q9Y6A2 1/20 0.46
DHODH Q02127 1/20 0.44
PDE3B Q13370 3/20 0.44
PDE3A Q14432 3/20 0.44
PDE1A P54750 2/20 0.44
PDE1B Q01064 2/20 0.44
PDE1C Q14123 2/20 0.44
NR4A2 P43354 1/20 0.43
AXL P30530 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
PKN1 Q16512 1/20 0.41
PKN2 Q16513 1/20 0.41
APAF1 O14727 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
SCHEMBL7277268 0.85 PDE1A (0.59) CYP46A1PDE3BPDE3APDE1APDE1B
SCHEMBL7746173 0.84 PDE1A (0.55) DHODHPDE3BPDE3APDE1APDE1B
SCHEMBL7747462 0.84 PDE1A (0.42) DHODHPDE3BPDE3APDE1APDE1B
SCHEMBL7746102 0.82 MAPT (0.42) DHODHPDE3BPDE3APDE1APDE1B
SCHEMBL7746654 0.80 PDE1A (0.50) CYP46A1PDE3BPDE3APDE1APDE1B
SCHEMBL7289650 0.80 PDGFRB (0.45) CYP46A1PDE3BPDE3APDE1APDE1B
SCHEMBL7746246 0.78 PDE1A (0.52) PDE3BPDE3APDE1APDE1BPDE1C
SCHEMBL7742026 0.78 PDE1A (0.52) PDE3BPDE3APDE1APDE1BPDE1C
SCHEMBL7742041 0.78 PDE1A (0.52) PDE3BPDE3APDE1APDE1BPDE1C
SCHEMBL7286762 0.77 PDE1A (0.50) CYP46A1PDE3BPDE3APDE1APDE1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214996-B1 SHOWING EXCELLENT BRONCHIOCONSTRICTION INHIBITORY ACTIVITY,USEFUL IN THE PROPHYLAXIS OR TREATNEBT OF ASTHMA TANABE SEIYAKU CO., LTD. (JP) 2001-04-10 US disclosed
US-6005106-A BRONCHOCONSTRICTOR AGENTS USEFUL IN THE TREATMENT OF ASTHMA TANABE SEIYAKU CO., LTD. (JP) 1999-12-21 US disclosed
US-5969140-A AMINOPYRIDINE DERIVATIVES OF NAPHTHALENE FOR TREATMENT OF ASTHMA AND BRONCHOCONSTRICTOR INHIBITORS TANABE SEIYAKU CO., LTD. (JP) 1999-10-19 US disclosed
EP-0748805-B1 Naphthalene derivatives, process for the preparation thereof, and intermediates therefor, and pharmaceutical compositions comprising them TANABE SEIYAKU CO (JP) 1998-04-08 EP disclosed
EP-0748805-A1 Naphthalene derivatives, process for the preparation thereof, and intermediates therefor, and pharmaceutical compositions comprising them TANABE SEIYAKU CO., LTD. (JP) 1996-12-18 EP disclosed