SCHEMBL7270989

SCHEMBL7270989

O=c1c2c(ncn2Cc2cccc([N+](=O)[O-])c2)c2cccnc2n1-c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.74
PDE4B Q07343 7/20 0.61
PDE4C Q08493 7/20 0.61
PDE4D Q08499 7/20 0.61
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.44
PDE1A P54750 1/20 0.44
PDE1B Q01064 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7271125 0.90 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL7272788 0.86 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL7278584 0.85 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7278375 0.85 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL7278166 0.84 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DPDE1A
SCHEMBL7280079 0.82 PDE4A (0.84) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL29416766 0.81 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL2278414 0.81 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL7338034 0.81 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7271034 0.81 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DPDE1A

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 4 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
EP-0459505-A1 Imidazonaphthyridine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-12-04 EP disclosed