SCHEMBL28828686

SCHEMBL28828686

CC1(C)Cc2cc(-c3ccc(Cl)c(F)c3)ccc2C1OC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.36
RORC P51449 2/20 0.35
ACACB O00763 4/20 0.33
ACACA Q13085 4/20 0.33
FFAR1 O14842 1/20 0.33
SLC9A1 P19634 1/20 0.33
CYP11B1 P15538 4/20 0.32
CYP11B2 P19099 4/20 0.32
KMO O15229 2/20 0.32
ABL1 P00519 1/20 0.32

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
SCHEMBL28828601 0.91 TDP2 (0.39) RORCSLC9A1
SCHEMBL28828604 0.90 CYP17A1 (0.33) CYP11B1CYP11B2
SCHEMBL28828703 0.90 PGR (0.38) SIRT1SLC9A1
SCHEMBL28828667 0.87 SLC6A3 (0.37) SLC9A1KMOABL1
SCHEMBL28828388 0.87 DAPK3 (0.38) SLC9A1CYP11B1CYP11B2
SCHEMBL28828640 0.86 SIRT2 (0.36) SIRT1SLC9A1
SCHEMBL28828426 0.86 KDM1A (0.39) CYP11B1CYP11B2
SCHEMBL29121267 0.85 SLC9A1 (0.33) SLC9A1
SCHEMBL28828522 0.85 DYRK1A (0.38) SLC9A1KMO
SCHEMBL29121288 0.85 TDP2 (0.43) FFAR1CYP11B1CYP11B2

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