SCHEMBL9209628

SCHEMBL9209628

Cn1cnc2c(=O)n(C)c3ccccc3c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.48
PDE4A P27815 2/20 0.47
PDE4B Q07343 2/20 0.47
PDE4C Q08493 2/20 0.47
PDE4D Q08499 2/20 0.47
KDM4E B2RXH2 9/20 0.46
ALDH1A1 P00352 9/20 0.46
HSD17B10 Q99714 7/20 0.46
HPGD P15428 4/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
AURKA O14965 1/20 0.46
KDR P35968 1/20 0.46
AURKB Q96GD4 1/20 0.46
GAA P10253 3/20 0.44
LMNA P02545 2/20 0.44
GLA P06280 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
SCHEMBL9209660 0.82 LMNA (0.53) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL9208527 0.81 ADORA3 (0.53) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL9214076 0.79 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9208164 0.79 P2RX4 (0.50) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9216893 0.79 ALDH1A1 (0.48) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9215327 0.79 PGR (0.59) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9206544 0.78 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9214081 0.78 PTGER4 (0.44) ADORA3PDE4APDE4BPDE4CPDE4D
SCHEMBL9215381 0.78 KDM4E (0.51) KDM4EALDH1A1HSD17B10HPGDGLA
SCHEMBL30881088 0.76 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DKDM4E

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