SCHEMBL17320403

SCHEMBL17320403

Cc1cc2c(cc1C)C(=O)C(Cc1ccncc1Br)CC2

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 6/20 0.48
CYP27A1 Q02318 3/20 0.48
CYP19A1 P11511 8/20 0.45
CYP26A1 O43174 6/20 0.44
ACHE P22303 1/20 0.40
PARP1 P09874 1/20 0.37

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
SCHEMBL17313217 0.88 ACHE (0.43) CYP24A1CYP27A1CYP19A1ACHEPARP1
SCHEMBL17320402 0.87 CYP24A1 (0.53) CYP24A1CYP27A1CYP19A1CYP26A1ACHE
SCHEMBL17320405 0.87 CYP19A1 (0.46) CYP24A1CYP27A1CYP19A1CYP26A1
SCHEMBL17320404 0.86 CYP19A1 (0.47) CYP24A1CYP27A1CYP19A1CYP26A1
SCHEMBL17313153 0.85 CYP24A1 (0.53) CYP24A1CYP27A1CYP19A1CYP26A1ACHE
SCHEMBL17320407 0.83 ACHE (0.46) CYP24A1CYP19A1CYP26A1ACHE
SCHEMBL17313346 0.82 CYP24A1 (0.73) CYP24A1CYP27A1CYP19A1CYP26A1ACHE
SCHEMBL17313246 0.75 METAP1 (0.50) CYP24A1CYP27A1CYP19A1ACHE
SCHEMBL15906580 0.74 ACHE (0.58) ACHE
SCHEMBL17313245 0.73 CYP19A1 (0.51) CYP24A1CYP27A1CYP19A1CYP26A1ACHE

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 CYP24A1 1704/4885CYP27A1 164/4885CYP19A1 791/4885

“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.