SCHEMBL9206544

SCHEMBL9206544

CCCCCn1c(=O)c2ncn(C)c2c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.55
PDE4B Q07343 1/20 0.55
PDE4C Q08493 1/20 0.55
PDE4D Q08499 1/20 0.55
PGR P06401 1/20 0.55
RORA P35398 1/20 0.55
RORC P51449 1/20 0.55
RORB Q92753 1/20 0.55
KDM4E B2RXH2 7/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 3/20 0.49
TOP2A P11388 2/20 0.49
LMNA P02545 2/20 0.49
HPGD P15428 2/20 0.49
TP53 P04637 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 6/20 0.47
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL9215327 0.96 PGR (0.59) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL9208527 0.91 ADORA3 (0.53) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL9209660 0.87 LMNA (0.53) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL9197545 0.86 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL9208110 0.85 PGR (0.58) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL9209945 0.84 PGR (0.57) PDE4APDE4BPDE4CPDE4DPGR
Hydrochloric Acid SCHEMBL9214689 0.84 PGR (0.57) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL9210569 0.84 PGR (0.57) PDE4APDE4BPDE4CPDE4DPGR
Hydrochloric Acid SCHEMBL9206590 0.82 PGR (0.56) PDE4APDE4BPDE4CPDE4DPGR
Hydrochloric Acid SCHEMBL9214838 0.82 PGR (0.56) PDE4APDE4BPDE4CPDE4DPGR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0386722-B1 Imidazoquinolone derivatives KYOWA HAKKO KOGYO KK (JP) 1995-07-26 EP disclosed
US-4994468-A Bronchodilators, antiallergens KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-19 US disclosed
EP-0386722-A1 Imidazoquinolone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-09-12 EP disclosed