SCHEMBL29228259

SCHEMBL29228259

CCCOc1ccc(-c2ccc3c(c2)CCC(C)(C)C3OC(N)=O)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.37
BTK Q06187 2/20 0.37
PPARA Q07869 11/20 0.37
PPARG P37231 7/20 0.35
PPARD Q03181 3/20 0.35

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
SCHEMBL29228413 0.95 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL29228388 0.92 ERN1 (0.38) PPARAPPARGPPARD
SCHEMBL28828435 0.90 CSNK2A1 (0.39) CSNK2A1BTK
SCHEMBL29121322 0.90 CSNK2A1 (0.39) CSNK2A1BTK
SCHEMBL29228359 0.89 BTK (0.38) BTKPPARAPPARG
SCHEMBL29228281 0.87 PTGS2 (0.38)
SCHEMBL29121177 0.86 PPARD (0.38) PPARAPPARD
SCHEMBL29121332 0.85 BACE1 (0.39) PPARAPPARG
SCHEMBL28828441 0.85 BACE1 (0.39) PPARAPPARG
SCHEMBL29228228 0.85 SLC6A3 (0.36)

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
CN-114746422-B Derivatives having 1,2,3, 4-tetrahydronaphthalene moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-03-12 CN claimed
CN-114746422-A Novel derivatives having 1,2,3, 4-tetrahydronaphthalene moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2022-07-12 CN claimed
CN-114746422-B Derivatives having 1,2,3, 4-tetrahydronaphthalene moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-03-12 CN disclosed
CN-114746422-A Novel derivatives having 1,2,3, 4-tetrahydronaphthalene moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2022-07-12 CN disclosed