SCHEMBL28828586

SCHEMBL28828586

CCCOc1c(C)cc(-c2ccc3c(c2)CC(C)(C)C3OC(N)=O)cc1C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSTA1 P08263 4/20 0.34
GSTP1 P09211 4/20 0.34
F2 P00734 1/20 0.31
F9 P00740 1/20 0.31
F10 P00742 1/20 0.31
PLAU P00749 1/20 0.31
PLAT P00750 1/20 0.31
F11 P03951 1/20 0.31
KLKB1 P03952 1/20 0.31
F7 P08709 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
SCHEMBL29121241 1.00 GSTA1 (0.34) GSTA1GSTP1F2F9F10
SCHEMBL29121302 0.92 KDM4E (0.33)
SCHEMBL28828704 0.92 KDM4E (0.33)
SCHEMBL29121319 0.90 GSTA1 (0.33) GSTA1GSTP1
SCHEMBL29121275 0.90 MAPT (0.36)
SCHEMBL28828406 0.89 GSTA1 (0.32) GSTA1GSTP1F2F9F10
SCHEMBL28828488 0.86 ACACB (0.37)
SCHEMBL28828606 0.86 CNR1 (0.36)
SCHEMBL29121320 0.85 GSTA1 (0.34) GSTA1GSTP1
SCHEMBL28828679 0.84 SLC13A5 (0.40)

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