SCHEMBL28828656

SCHEMBL28828656

CC(C)Oc1cccc(-c2ccc3c(c2)CC(C)(C)C3OC(N)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
FFAR4 Q5NUL3 3/20 0.42
PTPN5 P54829 1/20 0.41
BACE1 P56817 2/20 0.39
CTSD P07339 1/20 0.39
CNR1 P21554 1/20 0.38
SLC13A5 Q86YT5 1/20 0.37
NR4A2 P43354 1/20 0.37
DHODH Q02127 1/20 0.37
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B1 P14061 1/20 0.34

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
SCHEMBL28828383 0.92 RXRA (0.39) RXRARXRBFFAR4PTPN5KMT2A
SCHEMBL29121225 0.89 RXRA (0.44) RXRARXRBFFAR4PTPN5BACE1
SCHEMBL29228287 0.89 RXRA (0.44) RXRARXRBFFAR4PTPN5BACE1
SCHEMBL28828539 0.89 F2 (0.42) BACE1PLGPLAUPLAT
SCHEMBL29121199 0.89 FFAR4 (0.43) RXRARXRBFFAR4PTPN5BACE1
SCHEMBL29121283 0.89 FFAR4 (0.43) RXRARXRBFFAR4PTPN5BACE1
SCHEMBL28828592 0.87 NR4A2 (0.40) RXRARXRBFFAR4NR4A2DHODH
SCHEMBL28828501 0.86 RXRA (0.44) RXRARXRBPTPN5NR4A2HTT
SCHEMBL29121307 0.86 RXRA (0.44) RXRARXRBPTPN5NR4A2HTT
SCHEMBL28828698 0.85 IKBKB (0.38) FFAR4DHODH

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