SCHEMBL28828541

SCHEMBL28828541

CC1(C)Cc2ccc(-c3cc(Cl)cc(Cl)c3)cc2C1OC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.36
BACE1 P56817 8/20 0.34
RXRA P19793 2/20 0.33
RXRB P28702 2/20 0.33
CTSD P07339 2/20 0.33
SLC9A1 P19634 1/20 0.32
ASIC3 Q9UHC3 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR5 Q9H228 1/20 0.32
ALOX5 P09917 1/20 0.31
PTGS1 P23219 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
APP P05067 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
SCHEMBL28828623 0.91 JAK2 (0.35) PGRSLC9A1ALOX5PTGS1
SCHEMBL28828373 0.91 PGR (0.43) PGRBACE1SLC9A1
SCHEMBL28828610 0.90 RXRA (0.34) PGRBACE1RXRARXRBCTSD
SCHEMBL28828603 0.88 PGR (0.40) PGRS1PR1S1PR5
SCHEMBL28828657 0.85 PGR (0.34) PGRBACE1CTSDAPP
SCHEMBL28828437 0.85 PGR (0.34) PGRPTGS1
SCHEMBL28828381 0.85 KIF11 (0.34) PGRRXRAEDNRBEDNRA
SCHEMBL28950173 0.84 KLKB1 (0.36) PGR
SCHEMBL28950167 0.84 SLC9A1 (0.37) SLC9A1
SCHEMBL28828495 0.82 PGR (0.41) PGRSLC9A1ALOX5

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