SCHEMBL9203206

SCHEMBL9203206

CCCn1c(=O)c2nc[nH]c2c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.52
PDE4A P27815 9/20 0.49
PDE4B Q07343 9/20 0.49
PDE4C Q08493 9/20 0.49
PDE4D Q08499 9/20 0.49
ADORA2A P29274 7/20 0.49
ADORA2B P29275 5/20 0.49
KDM4E B2RXH2 3/20 0.48
GAA P10253 2/20 0.48
PGR P06401 2/20 0.47
RORA P35398 1/20 0.47
RORC P51449 1/20 0.47
RORB Q92753 1/20 0.47
TOP2A P11388 1/20 0.46
LMNA P02545 2/20 0.45
POLB P06746 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
USP2 O75604 1/20 0.45

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
SCHEMBL9197994 0.92 PGR (0.58) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL9204684 0.89 ALDH1A1 (0.49) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL6472578 0.83 ADORA2A (0.49) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL9851040 0.75 PDE4A (0.49) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL16099173 0.74 PARP1 (0.45) ADORA3KDM4EGAAPGRLMNA
SCHEMBL9208527 0.74 ADORA3 (0.53) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL9851037 0.72 LMNA (0.50) ADORA3ADORA2AADORA2BKDM4EGAA
SCHEMBL9198164 0.71 PDE4A (0.58) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL9218908 0.69 PLK1 (0.46) ADORA3KDM4EGAAPGRRORA
SCHEMBL13386557 0.69 ALDH1A1 (0.71) ADORA3KDM4EGAAPGRRORA

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-0411394-B1 Imidazoquinolone derivates KYOWA HAKKO KOGYO KK (JP) 1995-04-05 EP disclosed
US-5010084-A Antihistamines; asthma KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-04-23 US disclosed
EP-0411394-A1 Imidazoquinolone derivates KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-06 EP disclosed