SCHEMBL8260883

SCHEMBL8260883

CC(=O)c1ccc(Oc2cncnc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.70
RAB9A P51151 3/20 0.70
MAPT P10636 3/20 0.70
ESRRA P11474 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ACACB O00763 1/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
NPC1 O15118 1/20 0.46
STS P08842 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
PARP10 Q53GL7 2/20 0.44
KMT2A Q03164 1/20 0.44
PARP15 Q460N3 1/20 0.44
PARP14 Q460N5 1/20 0.44
PARP16 Q8N5Y8 1/20 0.44
PARP11 Q9NR21 1/20 0.44
PARP4 Q9UKK3 1/20 0.44

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
SCHEMBL203697 0.84 HPGD (1.00) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL3301210 0.84 HPGD (1.00) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL4085591 0.81 RAB9A (0.63) HPGDRAB9AMAPTGAASMN1; SMN2
SCHEMBL9789228 0.78 MAPT (0.86) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL755167 0.76 MAPT (0.83) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL13599772 0.76 MAPT (0.83) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL4100319 0.76 HPGD (0.83) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL903435 0.76 MAPT (0.83) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL9999838 0.76 MAPT (0.83) HPGDRAB9AMAPTESRRAL3MBTL1
SCHEMBL2556614 0.76 HPGD (0.83) HPGDRAB9AMAPTESRRAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100204245-A1 Amino-pyridines As Inhibitors Of Beta-secretase WYETH LLC (US) 2010-08-12 US disclosed
US-20100204245-A1 Amino-pyridines As Inhibitors Of Beta-secretase WYETH LLC (US) 2010-08-12 US disclosed
US-7732457-B2 Amino-pyridines as inhibitors of β-secretase WYETH LLC (US) 2010-06-08 US disclosed
US-7732457-B2 Amino-pyridines as inhibitors of β-secretase WYETH LLC (US) 2010-06-08 US disclosed
WO-2006083760-A1 AMINO-PYRIDINES AS INHIBITORS OF β-SECRETASE WYETH (US) 2006-08-10 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-20100204245-A1 Amino-pyridines As Inhibitors Of Beta-secretase BACE1, BACE2, APP HPGD 2903/4885RAB9A 2339/4885MAPT 12/4885

“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.