SCHEMBL28828566

SCHEMBL28828566

CCCOc1ccc(-c2cc3c(cc2OC)C(OC(N)=O)C(C)(C)C3)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.39
MGAM O43451 4/20 0.39
SI P14410 4/20 0.39
MGAM2 Q2M2H8 4/20 0.39
ERN1 O75460 1/20 0.38
ABCB1 P08183 2/20 0.37
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
PPARD Q03181 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
BACE1 P56817 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DPP4 P27487 1/20 0.34
RARG P13631 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL28828391 0.96 ABCB1 (0.37) GAAMGAMSIMGAM2ABCB1
SCHEMBL29121336 0.92 TSHR (0.35) GAAMGAMSIMGAM2ERN1
SCHEMBL28828389 0.92 ALDH1A1 (0.37) GAAERN1ABCB1LMNATSHR
SCHEMBL28828636 0.90 ERN1 (0.41) GAAERN1LMNATSHRBACE1
SCHEMBL29121168 0.89 FFAR4 (0.36) PPARDFFAR4
SCHEMBL28828399 0.87 FFAR4 (0.39) LMNATSHRMAPK1BACE1FFAR4
SCHEMBL29121169 0.87 FFAR4 (0.39) LMNATSHRMAPK1BACE1FFAR4
SCHEMBL28828396 0.87 NR1H4 (0.37) ERN1PPARDTP53
SCHEMBL28950186 0.86 FFAR4 (0.36) ABCB1FFAR4POLB
SCHEMBL29121291 0.86 PARP10 (0.36) GAATSHRNPSR1FFAR4HTT

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