SCHEMBL29664246

SCHEMBL29664246

Cc1cc(C(c2ccc(O)c(C)c2)c2ccccc2C(=O)O)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
KMT2A Q03164 5/20 0.62
TDP1 Q9NUW8 3/20 0.62
GAA P10253 1/20 0.62
MCL1 Q07820 3/20 0.43
MEN1 O00255 3/20 0.43
MAPT P10636 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP2C9 P11712 3/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
APEX1 P27695 1/20 0.42
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
KDM4E B2RXH2 5/20 0.42
HPGD P15428 4/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42

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
SCHEMBL1758278 0.84 TDP1 (0.45) ALDH1A1KMT2ATDP1GAAMEN1
SCHEMBL29015129 0.82 ALDH1A1 (0.62) ALDH1A1KMT2ATDP1GAAMCL1
SCHEMBL30483553 0.82 ALDH1A1 (0.62) ALDH1A1KMT2ATDP1GAAMCL1
SCHEMBL759633 0.80 GABRA1 (0.45) ALDH1A1KMT2ATDP1GAAMEN1
SCHEMBL29375022 0.80 GABRA1 (0.45) ALDH1A1KMT2ATDP1GAAMEN1
SCHEMBL18568766 0.79 ALDH1A1 (0.72) ALDH1A1KMT2ATDP1GAAMAPT
SCHEMBL3867410 0.78 ALDH1A1 (0.49) ALDH1A1KMT2ATDP1GAAMCL1
SCHEMBL438546 0.77 ALDH1A1 (1.00) ALDH1A1KMT2ATDP1GAAMAPT
SCHEMBL29636490 0.77 ALDH1A1 (1.00) ALDH1A1KMT2ATDP1GAAMAPT
SCHEMBL16018458 0.77 ALDH1A1 (0.84) ALDH1A1KMT2ATDP1GAAMCL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110770572-B Colorimetric assay ESSENLIX公司 2023-08-18 CN disclosed
WO-2022124129-A1 RESIN COMPOSITION, PREPREG, RESIN SHEET, METAL FOIL-CLAD LAYERED BOARD, AND PRINTED WIRING BOARD 三菱瓦斯化学株式会社 2022-06-16 WO disclosed
WO-2022124130-A1 COPPER-CLAD LAMINATED BOARD AND PRINTED WIRING BOARD 三菱瓦斯化学株式会社 2022-06-16 WO disclosed