SCHEMBL3203744

SCHEMBL3203744

CC(c1ccccc1)N1C/C(=N\O)C2(CCC2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 7/20 0.37
OPRL1 P41146 2/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
METAP2 P50579 2/20 0.36
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
CYP2D6 P10635 1/20 0.35
P2RX7 Q99572 1/20 0.34

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
SCHEMBL3195911 1.00 HSD11B1 (0.39) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL13484126 1.00 HSD11B1 (0.39) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL769860 0.95 KMT2A (0.41) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL769859 0.95 KMT2A (0.41) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL769861 0.95 KMT2A (0.41) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL785824 0.95 KMT2A (0.41) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL13483585 0.83 HSD11B1 (0.44) HSD11B1KMT2AMAPK1OPRL1OPRM1
SCHEMBL20183391 0.82 KMT2A (0.42) HSD11B1KMT2AMAPK1METAP2CYP2D6
SCHEMBL3189312 0.82 KMT2A (0.42) HSD11B1KMT2AMAPK1METAP2CYP2D6
SCHEMBL3189307 0.82 KMT2A (0.42) HSD11B1KMT2AMAPK1METAP2CYP2D6

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 4 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-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
US-5587386-A BACTERICIDES, MICROBIOCIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-12-24 US disclosed