SCHEMBL991885

SCHEMBL991885

CCN1C(=O)[C@@H]2[C@@H](C(F)(F)F)OC[C@]2(c2ccccc2F)N=C1NC(=O)O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 11/20 0.34
BACE2 Q9Y5Z0 6/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
UBE2M P61081 2/20 0.32
DCUN1D1 Q96GG9 2/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6920061 0.90 ALDH1A1 (0.36) BACE1BACE2GAAKMT2AALDH1A1
SCHEMBL8515730 0.89 BACE1 (0.38) BACE1BACE2
SCHEMBL8516042 0.86 ALDH1A1 (0.36) BACE1BACE2GAAKMT2ALMNA
SCHEMBL8516035 0.86 ALDH1A1 (0.36) BACE1BACE2GAAKMT2ALMNA
SCHEMBL11900491 0.79 BACE1 (0.54) BACE1BACE2
SCHEMBL6920051 0.79 BACE1 (0.37) BACE1BACE2ALDH1A1
SCHEMBL991173 0.78 BACE1 (0.38) BACE1BACE2KMT2AALDH1A1
SCHEMBL6919820 0.77 ALDH1A1 (0.36) BACE1BACE2GAAHTTALDH1A1
SCHEMBL11901104 0.77 BACE1 (0.41) BACE1BACE2
Ammonia Solution, Strong SCHEMBL8514730 0.76 BACE1 (0.40) BACE1BACE2

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 4 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
WO-2011009897-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD (JP) 2011-01-27 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-20120202828-A1 FUSED AMINODIHYDROPYRIMIDONE DERIVATIVES BACE1, APP, BACE2 BACE1 1/4885BACE2 3/4885GAA 485/4885

“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.