SCHEMBL892359

SCHEMBL892359

O=C1NC(=O)[C@@]2(N1)c1cc(Br)c(F)cc1O[C@H]1CCCO[C@@H]12

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.31
CTSB P07858 2/20 0.31
AKR1B10 O60218 1/20 0.30
MAPT P10636 1/20 0.30
AKR1A1 P14550 1/20 0.30
AKR1B1 P15121 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
SCHEMBL892231 1.00 BACE1 (0.31) BACE1CTSBAKR1B10MAPTAKR1A1
SCHEMBL891714 0.83 BACE1 (0.35) BACE1CTSBAKR1A1AKR1B1
SCHEMBL892228 0.83 BACE1 (0.35) BACE1CTSBAKR1A1AKR1B1
SCHEMBL892285 0.83 BACE1 (0.35) BACE1CTSBAKR1A1AKR1B1
SCHEMBL891705 0.83 BACE1 (0.35) BACE1CTSBAKR1A1AKR1B1
SCHEMBL891721 0.83 BACE1 (0.35) BACE1CTSBAKR1A1AKR1B1
SCHEMBL891784 0.82 BACE1 (0.38) BACE1CTSBAKR1B1
SCHEMBL892229 0.82 BACE1 (0.38) BACE1CTSBAKR1B1
SCHEMBL892004 0.80 BACE1 (0.37) BACE1CTSB
SCHEMBL892371 0.80 BACE1 (0.37) BACE1CTSB

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-20120083501-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-04-05 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-20120083501-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES BACE1, PSEN1, PSEN2 BACE1 1/4885CTSB 87/4885AKR1B10 1477/4885

“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.