SCHEMBL17320409

SCHEMBL17320409

Cc1ccc2c(c1)CCC(Cc1cc[n+](Cc3ccccc3)cc1Br)C2=O

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 17/20 0.73
CYP27A1 Q02318 2/20 0.53
CYP24A1 Q07973 2/20 0.53

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
SCHEMBL17320408 0.94 ACHE (0.82) ACHECYP27A1CYP24A1
Bromide SCHEMBL17313262 0.87 ACHE (0.85) ACHECYP27A1CYP24A1
SCHEMBL17320395 0.87 ACHE (0.75) ACHE
Bromide SCHEMBL17313372 0.85 ACHE (1.00) ACHECYP27A1CYP24A1
SCHEMBL17320423 0.82 ACHE (0.82) ACHE
SCHEMBL17320411 0.81 ACHE (0.83) ACHE
SCHEMBL17320436 0.80 ACHE (0.77) ACHE
SCHEMBL17320419 0.79 ACHE (0.76) ACHE
SCHEMBL17320417 0.79 ACHE (0.79) ACHE
SCHEMBL17320426 0.79 ACHE (0.58) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376387-B2 Oxidisable pyridine derivatives, their preparation and use as anti-alzheimer agents INSA INST NAT DES SCIENCES APPLIQUEES DE ROUEN (FR) 2016-06-28 US disclosed
US-20150353493-A1 OXIDISABLE PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS ANTI-ALZHEIMER AGENTS INSA (INSTITUT NATIONAL DES SCIENCES APPLIQUEES DE ROUEN (FR) 2015-12-10 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-20150353493-A1 OXIDISABLE PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE AS ANTI-ALZHEIMER AGENTS CBR3, CBR1, CYB5R3 ACHE 675/4885CYP27A1 164/4885CYP24A1 1704/4885

“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.