SCHEMBL592201

SCHEMBL592201

N#Cc1ccc2cccc(OS(=O)(=O)C(F)(F)F)c2n1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.54
SOS2 Q07890 1/20 0.50
PDE4A P27815 3/20 0.42
PDE4C Q08493 3/20 0.42
PDE4D Q08499 3/20 0.42
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
SLC40A1 Q9NP59 3/20 0.34
MCHR1 Q99705 1/20 0.34
PLAU P00749 1/20 0.33
HPGDS O60760 1/20 0.33
CTSS P25774 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
DRD2 P14416 1/20 0.32
HTR1D P28221 1/20 0.32
DRD3 P35462 1/20 0.32

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
SCHEMBL2944266 0.79 METAP2 (0.40) SRCPDE4APDE4CPDE4DMETAP2
SCHEMBL3580521 0.79 MEN1 (0.48) METAP2SLC40A1CA1CA2
SCHEMBL590594 0.77 MTNR1A (0.42) PDE4APDE4CPDE4DMETAP2METAP1
SCHEMBL2952108 0.76 SRC (0.61) SRCSOS2METAP2METAP1MCHR1
SCHEMBL249779 0.76 METAP2 (0.64) PDE4APDE4CPDE4DMETAP2METAP1
SCHEMBL7210527 0.74 ALDH1A1 (0.38) PDE4APDE4CPDE4DMETAP2METAP1
SCHEMBL4703472 0.73 SRC (0.61) SRCSOS2PDE4APDE4CPDE4D
SCHEMBL1195854 0.73 PDE4A (0.47) PDE4APDE4CPDE4DHPGDSCA1
SCHEMBL2118060 0.73 CA1 (0.45) PDE4DCA1CA2
SCHEMBL22588406 0.72 ALPL (0.41) PDE4APDE4CPDE4DMETAP2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146987-B1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-12-02 EP disclosed
US-8114867-B2 Oxazolidinone antibiotic derivatives ACTELION PHARMACEUTICALS LTD (CH) 2012-02-14 US disclosed
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-06-03 US disclosed
US-20100081650-A1 Antimicrobial Compounds AXTEN JEFFREY MICHAEL 2010-04-01 US disclosed
EP-2146987-A2 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2010-01-27 EP disclosed
US-7622481-B2 Antibacterial compounds GLAXO GROUP LIMITED (GB) 2009-11-24 US disclosed
EP-1537123-B1 AMINO-SUBSTITUTED CYCLOHEXANE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS GLAXO GROUP LTD (GB) 2009-04-29 EP disclosed
EP-1996579-A2 ANTIBIOTIC COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2008-12-03 EP disclosed
WO-2008126024-A2 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-10-23 WO disclosed
WO-2007105154-A2 ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2007-09-20 WO disclosed
EP-1799676-A2 NEW BICYCLIC ANTIBIOTICS Actelion Pharmaceuticals Ltd. (CH) 2007-06-27 EP disclosed
US-20060189604-A1 Compounds GLAXO GROUP LIMITED (GB) 2006-08-24 US disclosed
WO-2006032466-A2 NEW BICYCLIC ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2006-03-30 WO disclosed
EP-1537123-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-06-08 EP disclosed
WO-2004002992-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2004-01-08 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 (3 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-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES OXA1L, XDH, CCNY SRC 1626/4885SOS2 135/4885PDE4A 4055/4885
US-20060189604-A1 Compounds ELANE, PIGS, SDHA SRC 3309/4885SOS2 2509/4885PDE4A 2815/4885
US-20100081650-A1 Antimicrobial Compounds ELANE, NISCH, PIGS SRC 4426/4885SOS2 2248/4885PDE4A 2953/4885

“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.