SCHEMBL28828611

SCHEMBL28828611

CCCc1ccc(-c2cc3c(cc2F)C(OC(N)=O)C(C)(C)C3)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 10/20 0.36
RARB P10826 3/20 0.36
MPL P40238 1/20 0.35
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
S1PR1 P21453 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
FFAR1 O14842 1/20 0.31
RARA P10276 1/20 0.31
RARG P13631 1/20 0.31

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
SCHEMBL29121155 1.00 FFAR4 (0.36) FFAR4RARBMPLSLC6A2SLC6A4
SCHEMBL29121360 0.94 RARB (0.41) FFAR4RARBMPLS1PR1RARA
SCHEMBL28828449 0.94 RARB (0.41) FFAR4RARBMPLS1PR1RARA
SCHEMBL28828633 0.92 SLC6A2 (0.34) FFAR4RARBSLC6A2SLC6A4SLC6A3
SCHEMBL29121290 0.92 SLC6A2 (0.34) FFAR4RARBSLC6A2SLC6A4SLC6A3
SCHEMBL29228210 0.90 FFAR4 (0.35) FFAR4RARBMPLSLC6A2SLC6A4
SCHEMBL29121301 0.90 FFAR4 (0.35) FFAR4RARBMPLSLC6A2SLC6A4
SCHEMBL29121305 0.89 KDM1A (0.32) FFAR4FFAR1
SCHEMBL29121206 0.87 EPHX1 (0.36) FFAR4SLC6A2SLC6A4SLC6A3S1PR1
SCHEMBL28828600 0.87 EPHX1 (0.36) FFAR4SLC6A2SLC6A4SLC6A3S1PR1

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-114829361-B Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-16 CN claimed
CN-114829361-A Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing same 柳韩洋行 2022-07-29 CN claimed
CN-114829361-B Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-16 CN disclosed
CN-114829361-A Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing same 柳韩洋行 2022-07-29 CN disclosed