SCHEMBL11900689

SCHEMBL11900689

Cc1nc(/C(=N/N)c2ccccc2O)cc(N2CCOCC2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.48
▸ GAA P10253 5/20 0.45
▸ POLB P06746 4/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ GBA1 P04062 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HTT P42858 2/20 0.40
▸ CRHBP P24387 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ LMNA P02545 1/20 0.39

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
SCHEMBL1443320 1.00 MAPT (0.48) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1444466 0.88 GAA (0.54) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1444477 0.88 GAA (0.54) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1443116 0.88 PIK3CA (0.46) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1443109 0.88 PIK3CA (0.46) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1444102 0.76 GAA (0.53) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1444110 0.76 GAA (0.53) MAPTGAAPOLBMEN1KMT2A
SCHEMBL1444573 0.74 POLB (0.52) MAPTGAAPOLBKMT2AALDH1A1
SCHEMBL1444580 0.74 POLB (0.52) MAPTGAAPOLBKMT2AALDH1A1
SCHEMBL11961913 0.70 GAA (0.79) MAPTGAAPOLBMEN1KMT2A

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 MAPT 4432/4885GAA 1717/4885POLB 1945/4885

“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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