SCHEMBL5116913

SCHEMBL5116913

[O-][n+]1nc(Nc2cccnc2)nc2cc(Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.43
MAPT P10636 2/20 0.40
GLA P06280 1/20 0.40
NPC1 O15118 2/20 0.40
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCD Q05655 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GRIK1 P39086 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
KCNMA1 Q12791 1/20 0.38
ALPL P05186 1/20 0.38
RAD52 P43351 1/20 0.38
CYP11B2 P19099 3/20 0.38
RAB9A P51151 2/20 0.37
SRC P12931 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL4589890 0.83 PDE5A (0.43) CYP19A1MAPTNPC1ABL1PRKCA
SCHEMBL5107999 0.83 KMT2A (0.49) MAPTNPC1ABL1PRKCAPRKCD
SCHEMBL5119807 0.78 PRKCD (0.39) CYP19A1NPC1ABL1BCRPRKCA
SCHEMBL5118372 0.78 ALDH1A1 (0.39) CYP19A1MAPTGLANPC1ALDH1A1
SCHEMBL5111051 0.77 CHRNB2 (0.48) NPC1ALDH1A1ALPLRAB9ASRC
SCHEMBL5119393 0.75 CHRNB2 (0.46) ABL1BCRALDH1A1SRCKDM4E
SCHEMBL5118733 0.75 SRC (0.51) CYP19A1MAPTGLANPC1ABL1
SCHEMBL5108373 0.74 ABL1 (0.44) MAPTNPC1ABL1BCRPRKCA
SCHEMBL5108246 0.71 STK17A (0.44)
SCHEMBL6422103 0.71 ALDH1A1 (0.48) MAPTGLANPC1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234276-A1 Heterocyclic Triazines as Hypoxic Selective Protein Kinase Inhibitors SENTINEL ONCOLOGY LIMITED (UK) 2008-09-25 US claimed
EP-1846392-A2 HETEROCYCLIC TRIAZINES AS HYPOXIC SELECTIVE PROTEIN KINASE INHIBITORS Sentinel Oncology Limited (GB) 2007-10-24 EP claimed
WO-2006131835-A2 HETEROCYCLIC TRIAZINES AS HYPOXIC SELECTIVE PROTEIN KINASE INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2006-12-14 WO claimed
US-20080234276-A1 Heterocyclic Triazines as Hypoxic Selective Protein Kinase Inhibitors SENTINEL ONCOLOGY LIMITED (UK) 2008-09-25 US disclosed
EP-1846392-A2 HETEROCYCLIC TRIAZINES AS HYPOXIC SELECTIVE PROTEIN KINASE INHIBITORS Sentinel Oncology Limited (GB) 2007-10-24 EP disclosed
WO-2006131835-A2 HETEROCYCLIC TRIAZINES AS HYPOXIC SELECTIVE PROTEIN KINASE INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2006-12-14 WO 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-20080234276-A1 Heterocyclic Triazines as Hypoxic Selective Protein Kinase Inhibitors HIF1AN, HIF1A, CDK2 CYP19A1 2917/4885MAPT 3462/4885GLA 4102/4885

“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.