SCHEMBL7278701

SCHEMBL7278701

CCCCn1cnc2c3cccnc3n(-c3ccccc3)c(=O)c21

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.87
PDE4B Q07343 7/20 0.87
PDE4C Q08493 7/20 0.87
PDE4D Q08499 7/20 0.87
ALDH1A1 P00352 4/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 3/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PDE1A P54750 1/20 0.46
PDE1B Q01064 1/20 0.46
FEN1 P39748 1/20 0.44
LMNA P02545 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 2/20 0.41
CYP2C19 P33261 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 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
SCHEMBL7272694 0.96 PDE4A (0.84) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7271242 0.93 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7272931 0.91 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7271651 0.89 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7282375 0.89 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DALDH1A1
Hydrochloric Acid SCHEMBL7282370 0.89 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7271533 0.89 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7280031 0.86 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7278481 0.85 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7278716 0.83 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1

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