SCHEMBL11900792

SCHEMBL11900792

COc1ccc(O)c(C(=NN)c2nc(N3CCOCC3)nc(N3CCOCC3)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 5/20 0.48
▸ PIK3CA P42336 5/20 0.48
▸ PIK3CB P42338 4/20 0.48
▸ MAPT P10636 5/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ MTOR P42345 1/20 0.41
▸ HTT P42858 1/20 0.40

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
SCHEMBL1444580 0.80 POLB (0.52) PIK3CDPIK3CAPIK3CBMAPTKMT2A
SCHEMBL1444573 0.80 POLB (0.52) PIK3CDPIK3CAPIK3CBMAPTKMT2A
SCHEMBL11900613 0.78 MAPT (0.46) PIK3CAMAPTMEN1KMT2ATAAR1
SCHEMBL11900619 0.78 MAPT (0.46) PIK3CAMAPTMEN1KMT2ATAAR1
SCHEMBL11901244 0.74 GAA (0.47) PIK3CAMAPTMEN1KMT2ATAAR1
SCHEMBL11901252 0.74 GAA (0.47) PIK3CAMAPTMEN1KMT2ATAAR1
SCHEMBL3327957 0.70 MTOR (0.52) PIK3CDPIK3CAPIK3CBMAPTL3MBTL1
SCHEMBL11900782 0.70 MAPT (0.67) MAPTL3MBTL1MEN1KMT2ATAAR1
SCHEMBL11900786 0.70 MAPT (0.67) MAPTL3MBTL1MEN1KMT2ATAAR1
SCHEMBL6740893 0.69 MAPT (0.86) PIK3CDPIK3CAPIK3CBMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2473486-B2 PYRIMIDINES AS HEPCIDINE ANTAGONISTS VIFOR INT AG (CH) 2021-09-22 — — EP disclosed
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 PIK3CD 3704/4885PIK3CA 3070/4885PIK3CB 3760/4885

“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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