SCHEMBL8131012

SCHEMBL8131012

Cc1c(F)c(Cl)nc2c1c(=O)c(OC(=O)O)cn2C1CC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 7/20 0.37
▸ TOP2B Q02880 7/20 0.37
▸ DPP4 P27487 6/20 0.34
▸ KCNH2 Q12809 3/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ DRD1 P21728 1/20 0.32
▸ GSK3B P49841 1/20 0.31
▸ CACNA1F O60840 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CACNA1D Q01668 1/20 0.31
▸ CACNA1S Q13698 1/20 0.31
▸ CACNA1C Q13936 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
SCHEMBL5874340 0.83 TOP2A (0.53) TOP2ATOP2BDPP4KCNH2HRH3
SCHEMBL10377398 0.81 TOP2A (0.40) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL10376042 0.81 MEN1 (0.39) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL10377463 0.80 TOP2A (0.40) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL9047018 0.79 TOP2A (0.42) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL9388836 0.79 KCNH2 (0.51) TOP2ATOP2BDPP4KCNH2HRH3
SCHEMBL4774919 0.79 DPP4 (0.44) TOP2ATOP2BDPP4CHRM2DRD1
SCHEMBL7576170 0.78 STAT3 (0.44) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL7498379 0.78 KCNH2 (0.46) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL7840900 0.76 TOP2A (0.37) TOP2ATOP2BKCNH2MEN1KMT2A

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
EP-0704443-B1 Quinolone and naphthyridone carboxylic acid derivatives BAYER AG (DE) 2000-12-27 — — EP disclosed
EP-0705828-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1999-12-01 — — EP disclosed
EP-0721948-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1997-12-03 — — EP disclosed
EP-0721948-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-07-17 — — EP disclosed
EP-0705828-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-04-10 — — EP disclosed
EP-0704443-A2 Quinolone and naphthyridone carboxylic acid derivatives BAYER AG (DE) 1996-04-03 — — EP disclosed
EP-0589318-B1 Antibacterial 7-(aminomethyl-oxa-7-azabicyclo(3.3.0)oct-7-yl)quinolone- and -naphthyridonecarboxylic acid derivatives BAYER AG (DE) 1995-11-15 — — EP disclosed
EP-0589318-A2 Antibacterial 7-(aminomethyl-oxa-7-azabicyclo(3.3.0)oct-7-yl)quinolone- and -naphthyridonecarboxylic acid derivatives BAYER AG (DE) 1994-03-30 — — EP disclosed
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