SCHEMBL143295

SCHEMBL143295

O=C(O)c1cn(C2CC2)c2c(O)c(F)ccc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 7/20 0.60
TOP2B Q02880 7/20 0.60
ALDH1A1 P00352 4/20 0.48
POLB P06746 1/20 0.48
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
KDM4E B2RXH2 4/20 0.48
PIK3CD O00329 1/20 0.48
PIK3R1 P27986 1/20 0.48
PIK3CA P42336 1/20 0.48
PIK3CG P48736 1/20 0.48
LMNA P02545 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
KCNH2 Q12809 4/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL8084266 0.88 TOP2A (0.64) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL4482132 0.86 ALDH1A1 (0.58) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL2081014 0.86 TOP2A (0.56) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL8785240 0.84 TOP2A (0.54) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL30320686 0.83 TOP2A (0.68) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL584841 0.83 TOP2A (0.68) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL27339827 0.83 TOP2A (0.58) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL116421 0.83 KCNH2 (0.60) TOP2ATOP2BALDH1A1POLBOPRM1
SCHEMBL4208120 0.83 TOP2A (0.53) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL115123 0.82 ADRB2 (0.54) TOP2ATOP2BALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2012-03-08 US disclosed
EP-2256120-A1 Oxazolidinone-quinolone hybrids as antibacterial compounds Actelion Pharmaceuticals Ltd. (CH) 2010-12-01 EP disclosed
EP-2250171-A2 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS Achaogen, Inc. (US) 2010-11-17 EP disclosed
US-20100222302-A1 Novel Antibacterial Compounds ACTELION PHARMACEUTICALS LTD (CH) 2010-09-02 US disclosed
WO-2009137130-A2 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2009-11-12 WO disclosed
WO-2009137130-A2 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2009-11-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS RECQL, BLVRB, NQO2 TOP2A 125/4885TOP2B 31/4885ALDH1A1 1678/4885
US-20100222302-A1 Novel Antibacterial Compounds ODC1, AOC1, OGFOD1 TOP2A 4672/4885TOP2B 4842/4885ALDH1A1 2770/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.