SCHEMBL1010808

SCHEMBL1010808

FOC(F)(c1ccccc1)C1CCOC1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
CYP2D6 P10635 1/20 0.33
HRH1 P35367 1/20 0.33
SCN1A P35498 1/20 0.33
KMT2A Q03164 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
CCR6 P51684 1/20 0.31
KCNH2 Q12809 1/20 0.31
RAB9A P51151 1/20 0.31
CHRM3 P20309 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA5A P35218 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL1008632 0.77 LMNA (0.42) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL1017886 0.71 CYP2D6 (0.43) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL5656849 0.64
SCHEMBL28979281 0.63 LMNA (0.46) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL8229265 0.63 CYP2D6 (0.40) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL5666366 0.62 ICMT (0.35) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL6650588 0.62 KEAP1 (0.40) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL3942642 0.61 KCNN4 (0.36) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL2789967 0.61 KCNN4 (0.36) MEN1LMNACYP2D6HRH1SCN1A
SCHEMBL26503785 0.60

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-20120323001-A1 BACE INHIBITORS ELI LILLY AND COMPANY (US) 2012-12-20 US disclosed
US-8278441-B2 BACE inhibitors ELI LILLY AND COMPANY (US) 2012-10-02 US disclosed
US-20110009395-A1 BACE INHIBITORS ELI LILLY AND COMPANY (US) 2011-01-13 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 (2 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-20120323001-A1 BACE INHIBITORS BACE1, BACE2, APP MEN1 2551/4885LMNA 1737/4885CYP2D6 1293/4885
US-20110009395-A1 BACE INHIBITORS BACE1, BACE2, APP MEN1 2551/4885LMNA 1737/4885CYP2D6 1293/4885

“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.