SCHEMBL12486388

SCHEMBL12486388

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

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ EGLN1 Q9GZT9 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ HPGDS O60760 2/20 0.31
▸ EGFR P00533 1/20 0.30
▸ LCK P06239 1/20 0.30

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
SCHEMBL12489349 0.82 EGLN1 (0.36) ABCB1ABCG2EGLN1KDM4EHPGDS
SCHEMBL12487949 0.81 EGLN1 (0.34) EGLN1KDM4ECYP11B1CYP11B2HPGDS
SCHEMBL12489581 0.79 EGLN1 (0.35) EGLN1KDM4ECYP11B1CYP11B2HPGDS
SCHEMBL29777482 0.79 EGLN1 (0.35) EGLN1KDM4ECYP11B1CYP11B2HPGDS
SCHEMBL13684923 0.78 EGLN1 (0.33) EGLN1KDM4ECYP11B1CYP11B2HPGDS
SCHEMBL13685161 0.77 EGLN1 (0.36) EGLN1KDM4EHPGDS
SCHEMBL15501797 0.77 SLC40A1 (0.36) ABCB1ABCG2EGLN1KDM4E
SCHEMBL19484250 0.76 EGLN1 (0.35) ABCB1ABCG2EGLN1KDM4EHPGDS
SCHEMBL13685082 0.76 HPGDS (0.37) ABCB1ABCG2HPGDS
SCHEMBL20551081 0.75 SLC6A2 (0.39) KDM4EHPGDS

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 10 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
EP-2522658-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL/HORTICULTURAL GERMICIDE Nippon Soda Co., Ltd. (JP) 2012-11-14 — — EP disclosed
WO-2011081174-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL/HORTICULTURAL GERMICIDE 日本曹達株式会社 (JP) 2011-07-07 — — 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-20120289702-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL FUNGICIDE CBR3, CBR1, NOX3 ABCB1 2681/4885ABCG2 2097/4885EGLN1 367/4885

“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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