SCHEMBL13685161

SCHEMBL13685161

CC(C)(O)C(=O)c1c(F)cccc1Oc1cnc2c(F)cccc2c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 1/20 0.36
▸ HPGDS O60760 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.34
▸ GCK P35557 2/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ SRC P12931 1/20 0.33
▸ MET P08581 1/20 0.33
▸ SIRT2 Q8IXJ6 1/20 0.33
▸ SIRT1 Q96EB6 1/20 0.33
▸ SIRT3 Q9NTG7 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ PPARG P37231 2/20 0.32
▸ CCR2 P41597 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ CYSLTR2 Q9NS75 1/20 0.32
▸ CYSLTR1 Q9Y271 1/20 0.32
▸ PARP1 P09874 1/20 0.32
▸ PAX8 Q06710 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
SCHEMBL12489523 0.86 KMT2A (0.39) EGLN1HPGDSKDM4EGCKABL1
SCHEMBL12489917 0.84 EGLN1 (0.38) EGLN1HPGDSKDM4EGCKABL1
SCHEMBL12487949 0.81 EGLN1 (0.34) EGLN1HPGDSKDM4EGCKRAB9A
SCHEMBL12487968 0.81 KMT2A (0.41) EGLN1KDM4ERAB9A
SCHEMBL12489581 0.79 EGLN1 (0.35) EGLN1HPGDSKDM4EGCKPPARG
SCHEMBL29777482 0.79 EGLN1 (0.35) EGLN1HPGDSKDM4EGCKPPARG
SCHEMBL13684923 0.78 EGLN1 (0.33) EGLN1HPGDSKDM4EPAX8
SCHEMBL12486388 0.77 ABCB1 (0.32) EGLN1HPGDSKDM4E
SCHEMBL15501853 0.77 SLC40A1 (0.38) EGLN1HPGDSKDM4EGCKRAB9A
SCHEMBL15501771 0.77 SLC40A1 (0.38) EGLN1HPGDSGCK

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-2522658-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL/HORTICULTURAL GERMICIDE NIPPON SODA CO (JP) 2018-09-26 — — EP disclosed
US-8772200-B2 Nitrogen-containing heterocyclic compound and agricultural fungicide NIPPON SODA CO., LTD. (JP) 2014-07-08 — — US disclosed
US-8772200-B2 Nitrogen-containing heterocyclic compound and agricultural fungicide NIPPON SODA CO., LTD. (JP) 2014-07-08 — — US disclosed
US-8772200-B2 Nitrogen-containing heterocyclic compound and agricultural fungicide NIPPON SODA CO., LTD. (JP) 2014-07-08 — — US disclosed
US-20120289702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL FUNGICIDE NIPPON SODA CO., LTD. (JP) 2012-11-15 — — US disclosed
US-20120289702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL FUNGICIDE NIPPON SODA CO., LTD. (JP) 2012-11-15 — — US disclosed
US-20120289702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL FUNGICIDE NIPPON SODA CO., LTD. (JP) 2012-11-15 — — US disclosed
EP-2522658-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL/HORTICULTURAL GERMICIDE Nippon Soda Co., Ltd. (JP) 2012-11-14 — — EP 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-20120289702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL FUNGICIDE CBR3, CBR1, NOX3 EGLN1 367/4885HPGDS 4808/4885KDM4E 1921/4885

“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.

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