SCHEMBL7272860

SCHEMBL7272860

COc1ccc(-n2c(=O)c3c(ncn3Cc3ccccc3)c3cccnc32)cc1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.80
PDE4B Q07343 5/20 0.66
PDE4C Q08493 5/20 0.66
PDE4D Q08499 5/20 0.66
HPGD P15428 3/20 0.47
MAPT P10636 4/20 0.46
THRB P10828 1/20 0.46
ALDH1A1 P00352 3/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 3/20 0.45
RXFP1 Q9HBX9 1/20 0.45
PDE1A P54750 1/20 0.45
PDE1B Q01064 1/20 0.45
GLA P06280 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL7281463 0.96 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL7338034 0.90 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL7272788 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL7278166 0.89 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL7271311 0.89 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL7279741 0.85 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7279910 0.85 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7281912 0.83 PDE4A (0.87) PDE4APDE4BPDE4CPDE4DHPGD
SCHEMBL7278752 0.83 PDE4A (0.74) PDE4APDE4BPDE4CPDE4D
SCHEMBL7271255 0.82 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DMAPT

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
EP-0459505-B1 Imidazonaphthyridine derivatives KYOWA HAKKO KOGYO KK (JP) 1996-10-02 EP disclosed
US-5536730-A ANTIINFLAMMATORY, ANTIALLERGIC AND BRONCHODILATIVE ACTIVITY KYOWA HAKKO KOGYO CO. LTD. (JP) 1996-07-16 US disclosed
US-5468756-A Antiinflammatory, antiallergen KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-11-21 US disclosed
US-5364859-A Antiinflammatory agents, antiallergens, bronchodilators KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-11-15 US disclosed
EP-0459505-A1 Imidazonaphthyridine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-12-04 EP disclosed