SCHEMBL29178253

SCHEMBL29178253

O=C(O)c1cc(O)c(C(=O)O)cc1O.[La]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.56
CA2 P00918 4/20 0.56
ALDH1A1 P00352 4/20 0.56
CA12 O43570 3/20 0.56
CA7 P43166 3/20 0.56
CA9 Q16790 3/20 0.56
CA14 Q9ULX7 3/20 0.56
PTGS2 P35354 2/20 0.56
ALOX5 P09917 1/20 0.56
TSHR P16473 1/20 0.56
KDM4E B2RXH2 3/20 0.52
PTPN1 P18031 3/20 0.52
CYP3A4 P08684 2/20 0.52
MAPT P10636 2/20 0.52
MEN1 O00255 2/20 0.52
KDR P35968 2/20 0.52
KMT2A Q03164 2/20 0.52
THRB P10828 2/20 0.52
HPGD P15428 2/20 0.52
TNF P01375 1/20 0.52

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
SCHEMBL163610 0.97 CA1 (0.59) CA1CA2ALDH1A1CA12CA7
SCHEMBL5872953 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
Lithium SCHEMBL30876345 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
Hydrochloric Acid SCHEMBL28970646 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
SCHEMBL28398700 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
SCHEMBL3427286 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
SCHEMBL596197 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
SCHEMBL1498023 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
SCHEMBL22206251 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7
SCHEMBL28692073 0.94 CA1 (0.56) CA1CA2ALDH1A1CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117247694-A Preparation method of UV solvent-free anti-fouling environment-friendly ink for building material decoration 金华贝尔油墨有限公司 2023-12-19 CN claimed
CN-117247694-A Preparation method of UV solvent-free anti-fouling environment-friendly ink for building material decoration 金华贝尔油墨有限公司 2023-12-19 CN disclosed