SCHEMBL28828650

SCHEMBL28828650

CC(C)Cc1cccc(-c2ccc3c(c2)CC(C)(C)C3OC(N)=O)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 7/20 0.35
PRSS1 P07477 6/20 0.35
F2 P00734 3/20 0.35
GRIA2 P42262 2/20 0.35
PTGS2 P35354 2/20 0.33
PLG P00747 1/20 0.33
SLC5A1 P13866 2/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
PLA2G10 O15496 3/20 0.32
PLA2G2A P14555 3/20 0.32
PLA2G1B P04054 1/20 0.32
PLA2G5 P39877 1/20 0.32
PLA2G2C Q5R387 1/20 0.32
PLA2G12B Q9BX93 1/20 0.32
PLA2G12A Q9BZM1 1/20 0.32
PLA2G2F Q9BZM2 1/20 0.32
PLA2G3 Q9NZ20 1/20 0.32
PLA2G2E Q9NZK7 1/20 0.32
PLA2G2D Q9UNK4 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
SCHEMBL29121316 0.91 EPHX1 (0.36) PTGS2MMP2MMP9
SCHEMBL28828404 0.91 EPHX1 (0.36) PTGS2MMP2MMP9
SCHEMBL29121256 0.90 GRIA2 (0.34) F10PRSS1F2GRIA2PTGS2
SCHEMBL29121243 0.88 BCL2 (0.43) F10PRSS1F2GRIA2PTGS2
SCHEMBL28828387 0.88 BCL2 (0.43) F10PRSS1F2GRIA2PTGS2
SCHEMBL28828659 0.86 PLA2G10 (0.33) PTGS2PLA2G10PLA2G2APLA2G1BPLA2G5
SCHEMBL29121158 0.86 PLA2G10 (0.33) PTGS2PLA2G10PLA2G2APLA2G1BPLA2G5
SCHEMBL28828535 0.85 HTR7 (0.34) F10PLA2G10PLA2G2APLA2G1BPLA2G5
SCHEMBL29121307 0.84 RXRA (0.44) MMP2MMP9
SCHEMBL28828501 0.84 RXRA (0.44) MMP2MMP9

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