SCHEMBL7282135

SCHEMBL7282135

CCCCn1c(=O)c2c(ncn2C)c2cccnc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 1.00
PDE4B Q07343 9/20 1.00
PDE4C Q08493 9/20 1.00
PDE4D Q08499 9/20 1.00
ADORA2A P29274 3/20 0.52
MAPT P10636 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HTT P42858 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44
PGR P06401 1/20 0.44
RORA P35398 1/20 0.44
RORC P51449 1/20 0.44
RORB Q92753 1/20 0.44

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
SCHEMBL7271250 0.90 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL7270923 0.88 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL9197545 0.82 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL7278560 0.77 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL7272066 0.74 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL9215327 0.74 PGR (0.59) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL9198164 0.74 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL7278701 0.73 PDE4A (0.87) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL9195923 0.72 HPGD (0.57) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL9199179 0.72 PGR (0.59) PDE4APDE4BPDE4CPDE4DTDP1

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