SCHEMBL28828435

SCHEMBL28828435

CCCOc1ccc(-c2ccc3c(c2)CC(C)(C)C3OC(N)=O)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.39
BTK Q06187 2/20 0.38
MPI P34949 1/20 0.37
MAPT P10636 1/20 0.34
HSD17B10 Q99714 1/20 0.34
S1PR1 P21453 2/20 0.34
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
BACE1 P56817 1/20 0.33

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
SCHEMBL29121322 1.00 CSNK2A1 (0.39) CSNK2A1BTKMPIMAPTHSD17B10
SCHEMBL28828441 0.95 BACE1 (0.39) MPIS1PR1HTR2CBACE1
SCHEMBL29121332 0.95 BACE1 (0.39) MPIS1PR1HTR2CBACE1
SCHEMBL28828443 0.92 ERN1 (0.39) MAPTHSD17B10
SCHEMBL29121231 0.92 ERN1 (0.39) MAPTHSD17B10
SCHEMBL29228259 0.90 CSNK2A1 (0.37) CSNK2A1BTK
SCHEMBL29121275 0.89 MAPT (0.36) MAPTHSD17B10S1PR1BACE1
SCHEMBL29121340 0.88 BTK (0.39) BTKMAPTHSD17B10S1PR1HTR2C
SCHEMBL28828576 0.88 BTK (0.39) BTKMAPTHSD17B10S1PR1HTR2C
SCHEMBL29121357 0.87 KMO (0.45)

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