SCHEMBL9215381

SCHEMBL9215381

Cn1cnc2c(=O)n(CC(=O)O)c3ccccc3c21

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
GLA P06280 1/20 0.51
ADORA2B P29275 1/20 0.49
POLB P06746 1/20 0.48
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.46
ALDH1A1 P00352 2/20 0.46
AKR1B10 O60218 1/20 0.45
AKR1B1 P15121 1/20 0.45
APEX1 P27695 1/20 0.44
MAPK1 P28482 1/20 0.44
STAT3 P40763 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 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 0.87 LMNA (0.53) KDM4EHPGDALDH1A1MAPK1
SCHEMBL9215618 0.83 KDM4E (0.54) KDM4EPOLBHPGDHSD17B10ALDH1A1
SCHEMBL9208164 0.83 P2RX4 (0.50) KDM4EHSD17B10ALDH1A1MAPK1MEN1
SCHEMBL9208527 0.83 ADORA3 (0.53) KDM4EADORA2BPOLBHPGDHSD17B10
SCHEMBL9216893 0.81 ALDH1A1 (0.48) KDM4EHPGDHSD17B10ALDH1A1MAPK1
SCHEMBL9215327 0.81 PGR (0.59) KDM4EHPGDALDH1A1MEN1KMT2A
SCHEMBL9214081 0.80 PTGER4 (0.44) POLBHPGDALDH1A1MAPK1MEN1
SCHEMBL9206544 0.80 PDE4A (0.55) KDM4EHPGDHSD17B10ALDH1A1MAPK1
SCHEMBL9209628 0.78 ADORA3 (0.48) KDM4EGLAHPGDHSD17B10ALDH1A1
SCHEMBL9195923 0.76 HPGD (0.57) KDM4EHPGDHSD17B10ALDH1A1MAPK1

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