SCHEMBL11961929

SCHEMBL11961929

COc1ccc(CNc2nc(N3CCOCC3)nc(N3CCOCC3)n2)c(C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MAPT P10636 4/20 0.56
▸ PIK3CA P42336 6/20 0.54
▸ PIK3CD O00329 5/20 0.54
▸ PIK3CB P42338 3/20 0.54
▸ ALOX15 P16050 1/20 0.53
▸ HTT P42858 1/20 0.52
▸ MTOR P42345 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ TAAR1 Q96RJ0 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ CTSL P07711 1/20 0.47
▸ CTSB P07858 1/20 0.47
▸ CTSS P25774 1/20 0.47
▸ CTSK P43235 1/20 0.47

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
SCHEMBL1443432 0.88 MAPT (0.65) MEN1KMT2AMAPTPIK3CAPIK3CD
SCHEMBL13326034 0.79 HTT (0.65) MEN1KMT2AMAPTPIK3CAALOX15
SCHEMBL14503358 0.76 MAPT (0.65) MEN1KMT2AMAPTALOX15HTT
SCHEMBL18062216 0.73 PIK3CA (0.47) MAPTPIK3CAL3MBTL1ALDH1A1LMNA
SCHEMBL14504152 0.73 LMNA (0.53) MEN1KMT2AMAPTALOX15HTT
SCHEMBL32687782 0.71 MAPT (0.82) MEN1KMT2AMAPTALOX15HTT
SCHEMBL14147277 0.71 PIK3CD (0.50) MEN1KMT2AMAPTPIK3CAPIK3CD
SCHEMBL6740893 0.71 MAPT (0.86) MEN1KMT2AMAPTPIK3CAPIK3CD
SCHEMBL27742948 0.71 MAPT (0.70) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL14503838 0.71 HTT (0.50) MEN1KMT2AALOX15HTTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MEN1 4413/4885KMT2A 3797/4885MAPT 4432/4885

“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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