SCHEMBL7746622

SCHEMBL7746622

COc1cc2cc(CO)c(CO)c(-c3ccnc(N)c3)c2cc1OC

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 20/20 0.68
PDE3A Q14432 20/20 0.68
PDE4A P27815 19/20 0.68
PDE4B Q07343 19/20 0.68
PDE4C Q08493 19/20 0.68
PDE4D Q08499 19/20 0.68
PDE5A O76074 18/20 0.68
PDE1A P54750 17/20 0.68
PDE1B Q01064 17/20 0.68
PDE1C Q14123 17/20 0.68

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
SCHEMBL7746637 0.86 PDE4A (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7742029 0.86 PDE4A (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7741991 0.85 PDE4A (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7277011 0.84 PDE3B (0.72) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL19719696 0.83 PDE4A (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7747472 0.81 PDE4A (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7747662 0.81 PDE4A (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7747455 0.81 PDE4A (0.58) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL19719700 0.80 PDE4A (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7746508 0.80 PDE4A (0.59) PDE3BPDE3APDE4APDE4BPDE4C

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