SCHEMBL11900618

SCHEMBL11900618

Oc1ccc(C=NNc2nc(N3CCOCC3)nc(N3CCOCC3)n2)c(O)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.79
▸ KMT2A Q03164 8/20 0.79
▸ GAA P10253 7/20 0.79
▸ POLB P06746 6/20 0.79
▸ MEN1 O00255 6/20 0.79
▸ HTT P42858 4/20 0.79
▸ NPSR1 Q6W5P4 2/20 0.79
▸ KDM4E B2RXH2 5/20 0.73
▸ LMNA P02545 3/20 0.73
▸ APAF1 O14727 1/20 0.73
▸ PAX8 Q06710 1/20 0.73
▸ SENP7 Q9BQF6 1/20 0.73
▸ SENP6 Q9GZR1 1/20 0.73
▸ TAAR1 Q96RJ0 2/20 0.72
▸ AKR1C3 P42330 1/20 0.58
▸ AKR1C1 Q04828 1/20 0.58
▸ ALDH1A1 P00352 6/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ CYP1A2 P05177 1/20 0.54

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
SCHEMBL11961916 1.00 MAPT (0.79) MAPTKMT2AGAAPOLBMEN1
SCHEMBL11901247 0.92 MAPT (0.71) MAPTKMT2AGAAPOLBMEN1
SCHEMBL11961918 0.92 MAPT (0.71) MAPTKMT2AGAAPOLBMEN1
SCHEMBL12820169 0.88 MAPT (0.66) MAPTKMT2AGAAPOLBMEN1
SCHEMBL1444576 0.86 MAPT (0.69) MAPTKMT2AGAAPOLBMEN1
SCHEMBL11961917 0.86 MAPT (0.69) MAPTKMT2AGAAPOLBMEN1
SCHEMBL1444105 0.84 MAPT (1.00) MAPTKMT2AGAAPOLBMEN1
SCHEMBL11961914 0.84 MAPT (1.00) MAPTKMT2AGAAPOLBMEN1
SCHEMBL13745582 0.84 MAPT (1.00) MAPTKMT2AGAAPOLBMEN1
SCHEMBL26135457 0.81 MAPT (0.61) MAPTKMT2AGAAPOLBMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2473486-B1 PYRIMIDINES AS HEPCIDINE ANTAGONISTS VIFOR INT AG (CH) 2015-10-28 — — EP disclosed
US-20120202806-A1 Novel Pyrimidine- And Triazine-Hepcidine Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-09 — — 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-20120202806-A1 Novel Pyrimidine- And Triazine-Hepcidine Antagonists HAMP, DHPS, SLC40A1 MAPT 4432/4885KMT2A 3797/4885GAA 1717/4885

“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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