SCHEMBL1372763

SCHEMBL1372763

CCOC(=O)c1cc2ccc(C(F)(F)F)nc2n(C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.43
HPGD P15428 8/20 0.43
ALDH1A1 P00352 8/20 0.43
GAA P10253 6/20 0.43
HSD17B10 Q99714 5/20 0.43
MIF P14174 1/20 0.42
PFKFB3 Q16875 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAOB P27338 2/20 0.41
GLA P06280 4/20 0.41
CASP1 P29466 3/20 0.41
TSHR P16473 2/20 0.41
CASP7 P55210 2/20 0.41
POLB P06746 1/20 0.41
STAT6 P42226 1/20 0.41
KMT2A Q03164 1/20 0.41
HIF1A Q16665 1/20 0.41
CA12 O43570 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 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
SCHEMBL1372402 0.82 TAS2R14 (0.39) KDM4EHPGDALDH1A1HSD17B10KMT2A
Hydrochloric Acid SCHEMBL1372411 0.81 TAS2R14 (0.39) KDM4EHPGDALDH1A1HSD17B10KMT2A
SCHEMBL1372409 0.81 AHR (0.38) NPSR1
SCHEMBL2438657 0.78 ALDH1A1 (0.55) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL591704 0.77 KDM4E (0.46) KDM4EHPGDALDH1A1GAAHSD17B10
SCHEMBL1372818 0.77 AHR (0.55) KDM4EHPGDALDH1A1GAAHSD17B10
SCHEMBL127103 0.74 IDO1 (0.53) KDM4EHPGDALDH1A1NPSR1TSHR
SCHEMBL31697314 0.74 KDM4E (0.50) KDM4EHPGDALDH1A1GAANPSR1
SCHEMBL1498542 0.74 KDM4E (0.50) KDM4EHPGDALDH1A1GAANPSR1
SCHEMBL125773 0.73 KDM4E (0.41) KDM4EHPGDALDH1A1GAAHSD17B10

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 4 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

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 KDM4E 2575/4885HPGD 723/4885ALDH1A1 623/4885

“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.