SCHEMBL8445130

SCHEMBL8445130

COc1c(N2C[C@@H](C)[C@@H](N)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.71
KCNH2 Q12809 5/20 0.71
ALDH1A1 P00352 5/20 0.71
HPGD P15428 4/20 0.71
POLB P06746 3/20 0.71
HSD17B10 Q99714 2/20 0.71
TDP1 Q9NUW8 2/20 0.71
OPRM1 P35372 2/20 0.71
PRKD3 O94806 1/20 0.71
ALOX15 P16050 1/20 0.71
CLK2 P49760 1/20 0.71
CLK4 Q9HAZ1 1/20 0.71
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
LMNA P02545 2/20 0.64
CYP2C19 P33261 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
NPSR1 Q6W5P4 1/20 0.57
ATM Q13315 1/20 0.56
CHRM2 P08172 1/20 0.56

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
SCHEMBL9373510 1.00 KDM4E (0.71) KDM4EKCNH2ALDH1A1HPGDPOLB
SCHEMBL8445131 1.00 KDM4E (0.71) KDM4EKCNH2ALDH1A1HPGDPOLB
SCHEMBL9373526 1.00 KDM4E (0.71) KDM4EKCNH2ALDH1A1HPGDPOLB
SCHEMBL8445136 1.00 KDM4E (0.71) KDM4EKCNH2ALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL9846600 0.99 KDM4E (0.70) KDM4EKCNH2ALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL9773763 0.99 KDM4E (0.70) KDM4EKCNH2ALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL9846615 0.99 KDM4E (0.70) KDM4EKCNH2ALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL9846575 0.99 KDM4E (0.70) KDM4EKCNH2ALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL9846579 0.99 KDM4E (0.70) KDM4EKCNH2ALDH1A1HPGDPOLB
SCHEMBL6168969 0.95 KDM4E (0.69) KDM4EKCNH2ALDH1A1HPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4980470-A 8-alkoxyquinolonecarboxylic acid and salts thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-12-25 US claimed
EP-0464823-B1 (6,7-Substituted-8-alkoxy-1-cyclopropyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid-O3,O4)bis(acyloxy-O)borates and the salts thereof, and methods for their manufacture KYORIN SEIYAKU KK (JP) 1999-09-22 EP disclosed
EP-0230295-B1 8-alkoxyquinolonecarboxylic acid and salts thereof excellent in the selective toxicity and process of preparing the same KYORIN SEIYAKU KK (JP) 1994-05-25 EP disclosed
US-5157117-A (6,7)-SUBSTITUTED-8-ALKOXY-1-CYCLOPROPYL-1,4-DIHYDRO-4-OXO-3-QUINOLINECARBOXYLIC ACID-03,04) BIS (ACYLOXY-0) BORATE AND THE SALT THEREOF, AND THE PREPARING METHOD OF THE SAME KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-10-20 US disclosed
EP-0464823-A1 (6,7-Substituted-8-alkoxy-1-cyclopropyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid-O3,O4)bis(acyloxy-O)borates and the salts thereof, and methods for their manufacture KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-01-08 EP disclosed
US-5043450-A Bactericides KYORIN PHARMACEUTICAL CO., LTD. (JP) 1991-08-27 US disclosed
US-4980470-A 8-alkoxyquinolonecarboxylic acid and salts thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-12-25 US disclosed
EP-0230295-A2 8-alkoxyquinolonecarboxylic acid and salts thereof excellent in the selective toxicity and process of preparing the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 1987-07-29 EP disclosed