SCHEMBL2456936

SCHEMBL2456936

COc1ccc(Nc2nc(N)nc(N)n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.72
RAB9A P51151 4/20 0.72
POLB P06746 3/20 0.72
NPC1 O15118 3/20 0.72
ALDH1A1 P00352 2/20 0.72
KDM4E B2RXH2 2/20 0.72
JAK2 O60674 1/20 0.72
PKM P14618 1/20 0.72
GAA P10253 3/20 0.69
L3MBTL1 Q9Y468 3/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
SMN1; SMN2 Q16637 2/20 0.64
LMNA P02545 1/20 0.63
CHRNA7 P36544 1/20 0.62
KCNH3 Q9ULD8 1/20 0.58
NR4A1 P22736 1/20 0.58
THRB P10828 1/20 0.57
MAPK1 P28482 1/20 0.57
RECQL P46063 1/20 0.57

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
SCHEMBL28736275 0.90 MEN1 (0.66) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL11812041 0.86 MAPT (0.81) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL15671741 0.86 MAPT (0.60) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL10910614 0.84 CA12 (0.68) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL13921805 0.83 CDK5 (0.60) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL29130622 0.83 MAPT (0.73) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL13419268 0.82 RAB9A (0.71) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL2408726 0.80 RAB9A (0.82) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL10099686 0.79 KCNH3 (0.77) MAPTRAB9APOLBNPC1ALDH1A1
SCHEMBL10073747 0.79 KCNH3 (0.77) MAPTRAB9APOLBNPC1ALDH1A1

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
US-20110237587-A1 1,3,5-Triazine-2,4,6-Triamine Compound or Pharmaceutical Acceptable Salt Thereof, and Pharmaceutical Composition Comprising the Same HANALL PHARMACEUTICAL COMPANY, LTD (KR) 2011-09-29 US claimed
US-20110237587-A1 1,3,5-Triazine-2,4,6-Triamine Compound or Pharmaceutical Acceptable Salt Thereof, and Pharmaceutical Composition Comprising the Same HANALL PHARMACEUTICAL COMPANY, LTD (KR) 2011-09-29 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-20110237587-A1 1,3,5-Triazine-2,4,6-Triamine Compound or Pharmaceutical Acceptable Salt Thereof, and Pharmaceutical Composition Comprising the Same TP53, TP53BP1, SLC5A1 MAPT 2559/4885RAB9A 3342/4885POLB 2334/4885

“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.