SCHEMBL12489523

SCHEMBL12489523

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

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.39
▸ EGLN1 Q9GZT9 1/20 0.39
▸ HPGDS O60760 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ GCK P35557 1/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ PTK2 Q05397 1/20 0.35
▸ MET P08581 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ SIRT3 Q9NTG7 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CCR2 P41597 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ PARP1 P09874 2/20 0.34
▸ KRAS P01116 1/20 0.34
▸ PSMD14 O00487 1/20 0.34

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
SCHEMBL12489917 0.90 EGLN1 (0.38) KMT2AEGLN1HPGDSKDM4EGCK
SCHEMBL12488153 0.89 EGLN1 (0.41) KMT2AEGLN1HPGDSKDM4EGCK
SCHEMBL13685161 0.86 EGLN1 (0.36) EGLN1HPGDSKDM4EGCKABL1
SCHEMBL12487968 0.85 KMT2A (0.41) KMT2AEGLN1KDM4ERAB9AMEN1
SCHEMBL12489349 0.81 EGLN1 (0.36) EGLN1HPGDSKDM4EGCKSIRT2
SCHEMBL18920773 0.81 GCK (0.40) KMT2AEGLN1GCKABL1SRC
SCHEMBL18920685 0.80 KMT2A (0.39) KMT2AEGLN1GCKABL1SRC
SCHEMBL19484250 0.80 EGLN1 (0.35) EGLN1HPGDSKDM4EGCKSIRT2
SCHEMBL20551081 0.79 SLC6A2 (0.39) KMT2AHPGDSKDM4ERAB9AMEN1
SCHEMBL15501771 0.78 SLC40A1 (0.38) KMT2AEGLN1HPGDSGCKMEN1

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 KMT2A 1832/4885EGLN1 367/4885HPGDS 4808/4885

“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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