SCHEMBL9210461

SCHEMBL9210461

CCCCn1c(=O)c2nc(S)n(C)c2c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGR P06401 5/20 0.58
RORA P35398 5/20 0.58
RORC P51449 5/20 0.58
RORB Q92753 5/20 0.58
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
HPGD P15428 2/20 0.50
LMNA P02545 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 2/20 0.46
TOP2A P11388 1/20 0.46
GAA P10253 1/20 0.46
PLK1 P53350 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
MAPT P10636 1/20 0.45
PDE5A O76074 1/20 0.45
POLB P06746 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
SCHEMBL9206737 0.86 PGR (0.57) PGRRORARORCRORBALDH1A1
Hydrochloric Acid SCHEMBL9216356 0.86 PGR (0.57) PGRRORARORCRORBALDH1A1
Hydrochloric Acid SCHEMBL9217295 0.83 ALDH1A1 (0.55) PGRRORARORCRORBALDH1A1
Hydrochloric Acid SCHEMBL9206048 0.79 PGR (0.49) PGRRORARORCRORBALDH1A1
Hydrochloric Acid SCHEMBL9214677 0.79 ALDH1A1 (0.59) PGRRORARORCRORBALDH1A1
SCHEMBL9207552 0.78 PGR (0.59) PGRRORARORCRORBALDH1A1
SCHEMBL9215327 0.78 PGR (0.59) PGRRORARORCRORBALDH1A1
Hydrochloric Acid SCHEMBL9217286 0.78 PGR (0.47) PGRRORARORCRORBALDH1A1
Hydrochloric Acid SCHEMBL9206797 0.77 RORA (0.46) PGRRORARORCRORBALDH1A1
SCHEMBL9208110 0.77 PGR (0.58) PGRRORARORCRORBALDH1A1

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-0386722-B1 Imidazoquinolone derivatives KYOWA HAKKO KOGYO KK (JP) 1995-07-26 EP claimed
EP-0386722-A1 Imidazoquinolone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-09-12 EP claimed
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