SCHEMBL220261

SCHEMBL220261

COC(=O)c1cc(Br)cc([N+](=O)[O-])c1NC(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FGFR3 P22607 1/20 0.38
KDR P35968 1/20 0.38
NOTUM Q6P988 1/20 0.38
PKM P14618 1/20 0.37
SIRT6 Q8N6T7 1/20 0.36
ABCB1 P08183 1/20 0.35
ABCC1 P33527 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
AR P10275 3/20 0.35
PGR P06401 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SOS1 Q07889 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
SCHEMBL14347573 0.85 PDGFRB (0.38) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL15985062 0.82 ALDH1A1 (0.44) MEN1KMT2AARPGRCYP3A4
SCHEMBL16110049 0.81 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL1967675 0.80 ABL1 (0.48) NOTUMMEN1KMT2AVCAM1ALDH1A1
SCHEMBL28549978 0.80 AR (0.38) MEN1KMT2AARPGRCYP3A4
SCHEMBL306012 0.80 MEN1 (0.46) PKMMEN1KMT2ACYP2C9ALDH1A1
SCHEMBL28358908 0.79 GAA (0.36) ABCB1ABCC1MEN1KMT2AAR
SCHEMBL31248747 0.79 AR (0.38) PKMMEN1KMT2AARPGR
SCHEMBL17042263 0.78 SOS1 (0.36) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL14249660 0.78 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481544-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-07-09 US disclosed
US-8481544-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-07-09 US disclosed
US-8481544-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-07-09 US disclosed
US-8426426-B2 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-04-23 US disclosed
US-8426426-B2 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-04-23 US disclosed
US-8389516-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-03-05 US disclosed
EP-2034997-B1 ANTIBACTERIAL COMPOSITIONS BIOTA EUROPE LTD (GB) 2012-10-17 EP disclosed
US-20120004221-A1 Antibacterial Compositions BIOTA EUROPE LIMITED (GB) 2012-01-05 US disclosed
US-20120004221-A1 Antibacterial Compositions BIOTA EUROPE LIMITED (GB) 2012-01-05 US disclosed
US-20110263590-A1 Antibacterial Compositions BIOTA EUROPE LIMITED (GB) 2011-10-27 US disclosed
US-20110104207-A1 GYRASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-05-05 US disclosed
US-20110104207-A1 GYRASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-05-05 US disclosed
US-7727992-B2 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-01 US disclosed
US-7727992-B2 Gyrase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-01 US disclosed
US-20100105701-A1 GYRASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2010-04-29 US disclosed
US-20100105701-A1 GYRASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2010-04-29 US disclosed
US-20090197877-A1 Antibacterial Compositions PROLYSIS LTD. (GB) 2009-08-06 US disclosed
US-20090197877-A1 Antibacterial Compositions PROLYSIS LTD. (GB) 2009-08-06 US disclosed
EP-2034997-A1 ANTIBACTERIAL COMPOSITIONS Prolysis Limited (GB) 2009-03-18 EP disclosed
WO-2007148093-A1 ANTIBACTERIAL COMPOSITIONS PROLYSIS LTD. (GB) 2007-12-27 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 (5 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-20120004221-A1 Antibacterial Compositions CYCS, COX6C, RPS6 PDGFRB 2748/4885FGFR1 1696/4885PDGFRA 2923/4885
US-20090197877-A1 Antibacterial Compositions CYCS, COX6C, INTS6 PDGFRB 3566/4885FGFR1 3122/4885PDGFRA 4053/4885
US-20100105701-A1 GYRASE INHIBITORS AND USES THEREOF GMPS, NQO2, TOP1 PDGFRB 4443/4885FGFR1 4319/4885PDGFRA 4521/4885
US-20110104207-A1 GYRASE INHIBITORS AND USES THEREOF GMPS, NQO2, TOP1 PDGFRB 4443/4885FGFR1 4319/4885PDGFRA 4521/4885
US-20110263590-A1 Antibacterial Compositions CYCS, COX6C, RPS6 PDGFRB 2802/4885FGFR1 1572/4885PDGFRA 2931/4885

“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.