SCHEMBL448127

SCHEMBL448127

CN1C(=O)NC2(C1=O)c1cc(Br)ccc1CCC2CC1CCN(CC(F)F)CC1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 15/20 0.37
PLD2 O14939 2/20 0.34
PLD1 Q13393 2/20 0.34
OPRM1 P35372 2/20 0.32
DPP4 P27487 1/20 0.32

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
SCHEMBL447753 0.93 BACE1 (0.43) BACE1PLD2PLD1
SCHEMBL448245 0.86 AKR1B1 (0.34) BACE1PLD2PLD1OPRM1DPP4
SCHEMBL448810 0.80 BACE1 (0.43) BACE1
SCHEMBL446718 0.73 BACE1 (0.50) BACE1
SCHEMBL448182 0.70 ACHE (0.46) BACE1
SCHEMBL445942 0.67 BACE1 (0.48) BACE1
SCHEMBL429267 0.66 BACE1 (0.45) BACE1
SCHEMBL10272228 0.66 BACE1 (0.45) BACE1
SCHEMBL446114 0.66 BACE1 (0.45) BACE1
SCHEMBL427967 0.66 BACE1 (0.45) BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 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 (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-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES APP, BACE1, PSEN1 BACE1 2/4885PLD2 3804/4885PLD1 3313/4885

“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.