SCHEMBL1373668

SCHEMBL1373668

COC(=O)c1cccnc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 3/20 0.44
PKM P14618 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAP2K1 Q02750 1/20 0.43
SLC40A1 Q9NP59 1/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA5A P35218 1/20 0.40
CA9 Q16790 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
DHODH Q02127 1/20 0.40

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
SCHEMBL3878750 0.85 NAPRT (0.49) TDP1L3MBTL1PKMALDH1A1MAPT
SCHEMBL27313359 0.81 TDP1 (0.61) TDP1L3MBTL1PKMALDH1A1MAPT
SCHEMBL535696 0.78 L3MBTL1 (0.48) TDP1L3MBTL1PKMALDH1A1HTT
SCHEMBL9300864 0.78 PDCD1 (0.38) TDP1L3MBTL1MAPTSMN1; SMN2KDM4E
SCHEMBL22235655 0.77 TDP1 (0.57) TDP1L3MBTL1PKMALDH1A1MAPT
SCHEMBL2718494 0.77 SLC40A1 (0.47) TDP1ALDH1A1MAP2K1SLC40A1KDM4E
SCHEMBL311206 0.77 TDP1 (0.69) TDP1L3MBTL1PKMALDH1A1MAPT
SCHEMBL13473869 0.77 TUBB4A (0.50) ALDH1A1MAPTKDM4ELMNARAB9A
SCHEMBL4442981 0.77 L3MBTL1 (0.61) L3MBTL1ALDH1A1MAPTHTTKDM4E
SCHEMBL28621597 0.76 SLC40A1 (0.39) TDP1L3MBTL1MAPTMAP2K1SLC40A1

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-2394995-B1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES KUMIAI CHEMICAL INDUSTRY CO (JP) 2014-01-15 EP disclosed
US-8334236-B2 Ring-fused 2-pyridone derivatives and herbicides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2012-12-18 US disclosed
EP-2394995-A1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES Kumiai Chemical Industry CO., LTD. (JP) 2011-12-14 EP disclosed
US-20110287937-A1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2011-11-24 US disclosed
EP-1087943-B1 THERAPEUTIC BIARYL DERIVATIVES GLAXO GROUP LTD (GB) 2005-08-17 EP disclosed
US-6251925-B1 AN AGONISTS FOR HUMAN BETA-3 ADRENOCEPTOR GLAXO WELLCOME INC. 2001-06-26 US disclosed
EP-1087943-A1 THERAPEUTIC BIARYL DERIVATIVES GLAXO GROUP LIMITED (GB) 2001-04-04 EP disclosed
WO-1999065877-A1 THERAPEUTIC BIARYL DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-12-23 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 (1 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-20110287937-A1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES CBR3, CBR1, CHRM1 TDP1 2935/4885L3MBTL1 944/4885PKM 710/4885

“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.