SCHEMBL3246191

SCHEMBL3246191

CC(C)COc1cccc(C2(c3ccc(OC(F)F)cc3)NC(N)c3ncccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 18/20 0.41
CTSD P07339 4/20 0.37
BACE2 Q9Y5Z0 3/20 0.34
PDK2 Q15119 1/20 0.33
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
REN P00797 2/20 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
SCHEMBL3248669 0.88 AAK1 (0.32) PDK2
SCHEMBL3248214 0.79 GALR3 (0.40) PDK2
SCHEMBL3242727 0.77 BACE1 (0.37) BACE1
SCHEMBL3243724 0.74 KDM1A (0.40) BACE1CTSDBACE2
SCHEMBL3240569 0.74 BACE1 (0.32) BACE1
SCHEMBL3246185 0.74 BACE1 (0.53) BACE1CTSDBACE2REN
SCHEMBL3243582 0.73 PDK2 (0.35) BACE1PDK2
SCHEMBL3242194 0.73 ADAM17 (0.36) BACE1PDK2
SCHEMBL3769871 0.73 BACE1 (0.37) BACE1CTSDBACE2
SCHEMBL3358031 0.72 CTSD (0.33) BACE1CTSD

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-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 US claimed
WO-2010056195-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 WO claimed
US-20100125087-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 US disclosed
WO-2010056195-A1 NEW COMPOUNDS 575 ASTRAZENECA AB (SE) 2010-05-20 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-20100125087-A1 NEW COMPOUNDS 575 PSEN1, PSEN2, BACE1 BACE1 3/4885CTSD 620/4885BACE2 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.