SCHEMBL28828516

SCHEMBL28828516

CCOc1ccc(-c2ccc3c(c2)CC(CC)(CC)C3OC(N)=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 3/20 0.40
PARP10 Q53GL7 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
ALDH1A1 P00352 2/20 0.36
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35

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
SCHEMBL28950171 0.92 RARB (0.37) PPARD
SCHEMBL28828472 0.91 RXRA (0.46) PPARDRXRARXRB
SCHEMBL28828756 0.90 CHRNB2 (0.39) PPARDALDH1A1
SCHEMBL29121247 0.88 PARP10 (0.39) PPARDPARP10RXRARXRBALDH1A1
SCHEMBL28828590 0.88 PARP10 (0.39) PPARDPARP10RXRARXRBALDH1A1
SCHEMBL28828749 0.87 FFAR4 (0.39) PARP10RXRARXRB
SCHEMBL28828450 0.86 KDM1A (0.36) PPARAPPARG
SCHEMBL28828439 0.86 PPARA (0.36) PPARDPPARAPPARG
SCHEMBL28828685 0.86 KDM4E (0.32) PPARDALDH1A1
SCHEMBL28828627 0.84 MCL1 (0.38)

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