SCHEMBL7743887

SCHEMBL7743887

COC(=O)c1cc2cc(OC)c(OC)cc2c(-c2cccnc2Cl)c1C(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 12/20 0.47
PDE1B Q01064 12/20 0.47
PDE1C Q14123 12/20 0.47
PDE3B Q13370 5/20 0.47
PDE3A Q14432 5/20 0.47
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
POLB P06746 2/20 0.42
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL7746115 0.82 PDE1A (0.51) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7747342 0.79 PDE1A (0.48) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7747219 0.79 PDE1A (0.54) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7746120 0.79 PDE1A (0.50) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7746534 0.78 PDE3B (0.63) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7277268 0.77 PDE1A (0.59) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7746193 0.77 PDE1A (0.54) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL13668874 0.76 PDE1A (0.55) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL983806 0.75 PDE1A (0.68) PDE1APDE1BPDE1CPDE3BPDE3A
SCHEMBL7742053 0.74 PDE1A (0.51) PDE1APDE1BPDE1CPDE3BPDE3A

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