SCHEMBL15501853

SCHEMBL15501853

CC(C)(C(=O)O)c1ncccc1Oc1cnc2c(F)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 2/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.37
▸ LMNA P02545 4/20 0.35
▸ L3MBTL1 Q9Y468 4/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PAX8 Q06710 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CYSLTR2 Q9NS75 1/20 0.34
▸ CYSLTR1 Q9Y271 1/20 0.34
▸ SLC16A3 O15427 1/20 0.34
▸ SLC16A1 P53985 1/20 0.34
▸ METAP2 P50579 1/20 0.34
▸ METAP1 P53582 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HPGDS O60760 1/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ GCK P35557 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
SCHEMBL15501771 0.92 SLC40A1 (0.38) SLC40A1EGLN1LMNAL3MBTL1ALDH1A1
SCHEMBL15501807 0.87 EGLN1 (0.38) SLC40A1EGLN1ALDH1A1CYSLTR2CYSLTR1
SCHEMBL15501845 0.87 SLC40A1 (0.35) SLC40A1EGLN1LMNAL3MBTL1ALDH1A1
SCHEMBL15501854 0.84 SLC40A1 (0.39) SLC40A1EGLN1L3MBTL1HPGDSKMT2A
SCHEMBL15501797 0.83 SLC40A1 (0.36) SLC40A1EGLN1LMNAL3MBTL1ALDH1A1
SCHEMBL15501891 0.82 HPGDS (0.37) SLC40A1LMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL13685161 0.77 EGLN1 (0.36) EGLN1PAX8KDM4ECYSLTR2CYSLTR1
SCHEMBL12487949 0.76 EGLN1 (0.34) EGLN1KDM4EHPGDSGCKNPC1
SCHEMBL12489523 0.76 KMT2A (0.39) EGLN1KDM4EHPGDSKMT2AGCK
SCHEMBL12489581 0.74 EGLN1 (0.35) SLC40A1EGLN1KDM4EHPGDSGCK

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-2711361-B1 NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE NIPPON SODA CO (JP) 2016-06-29 — — EP disclosed
US-9060517-B2 Nitrogenated heterocyclic compound and agricultural or horticultural fungicide NIPPON SODA CO., LTD. (JP) 2015-06-23 — — US disclosed
US-9060517-B2 Nitrogenated heterocyclic compound and agricultural or horticultural fungicide NIPPON SODA CO., LTD. (JP) 2015-06-23 — — US disclosed
US-9060517-B2 Nitrogenated heterocyclic compound and agricultural or horticultural fungicide NIPPON SODA CO., LTD. (JP) 2015-06-23 — — US disclosed
EP-2711361-A1 NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE Nippon Soda Co., Ltd. (JP) 2014-03-26 — — EP disclosed
US-20140073792-A1 NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE NIPPON SODA CO., LTD. (JP) 2014-03-13 — — US disclosed
US-20140073792-A1 NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE NIPPON SODA CO., LTD. (JP) 2014-03-13 — — US disclosed
US-20140073792-A1 NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE NIPPON SODA CO., LTD. (JP) 2014-03-13 — — 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-20140073792-A1 NITROGENATED HETEROCYCLIC COMPOUND AND AGRICULTURAL OR HORTICULTURAL FUNGICIDE CBR3, CBR1, NOX3 SLC40A1 2307/4885EGLN1 311/4885LMNA 3574/4885

“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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