SCHEMBL3197007

SCHEMBL3197007

CC(C)(C)OC(=O)NC1(C(=O)OC(C)(C)C)CCNC1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
GHSR Q92847 1/20 0.32
GAA P10253 2/20 0.31
CTSL P07711 1/20 0.31
P2RX7 Q99572 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL3197011 1.00 KMT2A (0.34) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL23120812 0.92 KMT2A (0.33) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL21624845 0.92 KMT2A (0.33) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL1649897 0.88 KMT2A (0.34) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL23120791 0.88 KMT2A (0.38) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL2340622 0.88 KMT2A (0.38) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL15760564 0.87 OPRM1 (0.37) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL15645461 0.86 KMT2A (0.47) KMT2AKDM4EMEN1MAPK1GHSR
SCHEMBL22962157 0.86 MEN1 (0.32) KMT2AMEN1MAPK1
SCHEMBL22962047 0.85 TDP1 (0.33) GHSR

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
US-RE41149-E1 Stereoisomerically pure 7-[(7S)-7-amino-5-azaspiro[2.4]heptan-5-yl]-6-fluoro-1-[(1R,2S)-2-fluoro-1-cyclopropyl]-8-methoxy-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid or a pharmaceutically acceptable salt thereof; antibacterial agents DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-02-23 US disclosed
US-6031102-A Optically active pyridonecarboxylic acid derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-02-29 US disclosed
EP-0341493-B1 Optically active pyridonecarboxylic acid derivatives DAIICHI SEIYAKU CO (JP) 1999-07-14 EP disclosed
US-5767127-A BACTERICIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-06-16 US disclosed
US-5587386-A BACTERICIDES, MICROBIOCIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-12-24 US disclosed