SCHEMBL8516276

SCHEMBL8516276

CN1C(=O)[C@@H]2COC[C@]2(c2cc([N+](=O)[O-])ccc2F)N=C1NC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE2 Q9Y5Z0 15/20 0.41
BACE1 P56817 14/20 0.41
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
WDR5 P61964 3/20 0.36

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
SCHEMBL8516273 1.00 BACE2 (0.41) BACE2BACE1MAPTKMT2AL3MBTL1
SCHEMBL8516270 1.00 BACE2 (0.41) BACE2BACE1MAPTKMT2AL3MBTL1
SCHEMBL6921552 0.88 DRD2 (0.40) BACE2BACE1L3MBTL1
SCHEMBL8516712 0.85 BACE1 (0.48) BACE2BACE1
SCHEMBL8516710 0.85 BACE1 (0.48) BACE2BACE1
SCHEMBL8516412 0.83 MAPT (0.40) BACE2BACE1MAPTKMT2AL3MBTL1
SCHEMBL8516408 0.83 MAPT (0.40) BACE2BACE1MAPTKMT2AL3MBTL1
SCHEMBL6920006 0.83 BACE1 (0.59) BACE2BACE1
SCHEMBL11900582 0.83 BACE1 (0.59) BACE2BACE1
SCHEMBL8515501 0.83 BACE1 (0.45) BACE2BACE1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139594-B2 Fused aminodihydropyrimidone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-09-22 US disclosed
US-20120202828-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-08-09 US disclosed
EP-2456771-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2012-05-30 EP 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-20120202828-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES BACE1, APP, BACE2 BACE2 3/4885BACE1 1/4885MAPT 49/4885

“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.