SCHEMBL28857298

SCHEMBL28857298

COc1cc(C(=O)O)cc2c(OC)cc(C(=O)O)cc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.69
CA2 P00918 3/20 0.69
CA12 O43570 2/20 0.69
CA4 P22748 2/20 0.69
CA6 P23280 2/20 0.69
CA7 P43166 2/20 0.69
CA9 Q16790 2/20 0.69
CA14 Q9ULX7 2/20 0.69
CA3 P07451 1/20 0.69
PKM P14618 1/20 0.69
CA5A P35218 1/20 0.69
CA5B Q9Y2D0 1/20 0.69
PTGS2 P35354 1/20 0.64
TPMT P51580 3/20 0.61
HTT P42858 2/20 0.57
CNR2 P34972 1/20 0.56
TSHR P16473 3/20 0.52
LMNA P02545 2/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL28857372 0.90 CA12 (0.63) CA1CA2CA12CA4CA6
SCHEMBL29771941 0.90 CA12 (0.63) CA1CA2CA12CA4CA6
SCHEMBL1812029 0.87 CA12 (0.55) CA1CA2CA12CA4CA6
SCHEMBL27185256 0.86 CA12 (0.53) CA1CA2CA12CA4CA6
SCHEMBL3779930 0.84 TPMT (0.58) CA1CA2CA12CA4CA6
SCHEMBL8960918 0.83 CA12 (0.62) CA1CA2CA12CA4CA6
SCHEMBL9515990 0.82 CA1 (0.69) CA1CA2CA12CA4CA6
SCHEMBL668540 0.82 CA12 (0.69) CA1CA2CA12CA4CA6
3,4,5-Trimethoxybenzoic Acid SCHEMBL6592 0.82 TPMT (0.78) CA1CA2CA12CA4CA6
Syringic Acid SCHEMBL27602358 0.82 CA12 (1.00) CA1CA2CA12CA4CA6

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-114853992-B Soluble low dielectric constant low dielectric loss flame-retardant wholly aromatic copolyester and preparation method and application thereof 四川大学 2024-04-26 CN disclosed
CN-114853992-A Soluble low-dielectric-constant low-dielectric-loss flame-retardant full-aromatic copolyester and preparation method and application thereof 四川大学 2022-08-05 CN disclosed