SCHEMBL11278084

SCHEMBL11278084

O=C(O)c1ccc(OC(=O)c2ccccc2C(=O)O)c(C(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.54
HSD17B10 Q99714 5/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 3/20 0.54
LMNA P02545 3/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CDC25A P30304 1/20 0.50
CDC25B P30305 1/20 0.50
AKR1C3 P42330 1/20 0.49
ALOX15 P16050 1/20 0.47
ESR1 P03372 2/20 0.46
ESR2 Q92731 1/20 0.46
TSHR P16473 3/20 0.46
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
HMGB1 P09429 1/20 0.46
GGT1 P19440 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46

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
SCHEMBL11199694 0.90 KDM4E (0.57) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL11285516 0.87 ESR1 (0.58) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL28087705 0.85 ESR1 (0.59) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL11275036 0.84 ESR1 (0.50) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL11197836 0.83 KDM4E (0.54) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL11208120 0.80 KDM4E (0.79) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL10787732 0.80 ALDH1A1 (0.67) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL5830907 0.80 KDM4E (0.41) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL3693858 0.79 KDM4E (0.61) KDM4EHSD17B10ALDH1A1LMNACDC25A
SCHEMBL6853171 0.79 KDM4E (0.61) KDM4EHSD17B10ALDH1A1LMNACDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0052927-A2 Stretched film structure of the poly-1,3-phenylene terephthalate type MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-06-02 EP disclosed