SCHEMBL28828705

SCHEMBL28828705

CCOc1ccccc1-c1ccc2c(c1)CC(C)(C)C2OC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.44
DHFR P00374 1/20 0.41
CTSA P10619 1/20 0.39
HTR2C P28335 2/20 0.38
SLC9A1 P19634 1/20 0.38
PDE10A Q9Y233 3/20 0.38
ABL1 P00519 4/20 0.37
HTR2A P28223 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
GRM2 Q14416 1/20 0.34
MME P08473 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
SCHEMBL28828475 0.90 FFAR4 (0.44) PTPRCPDE10AABL1ALDH1A1MAPT
SCHEMBL28828688 0.90 EGFR (0.39) PTPRCTDP1
SCHEMBL28828490 0.89 FFAR2 (0.40) ALDH1A1
SCHEMBL28828374 0.89 CTSA (0.40) PTPRCDHFRCTSAALDH1A1MAPT
SCHEMBL28828448 0.88 KDM6B (0.38) SLC9A1ABL1
SCHEMBL28828483 0.88 EDNRB (0.42) PTPRCDHFR
SCHEMBL28828680 0.88 SLC9A1 (0.42) DHFRHTR2CSLC9A1ABL1HTR2A
SCHEMBL29121312 0.85 ALDH1A1 (0.36) ALDH1A1HPGDMAPT
SCHEMBL28950165 0.85 CAMKK2 (0.40) CTSASLC9A1ABL1CA1CA2
SCHEMBL28828661 0.84 SCN9A (0.37) ABL1

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