SCHEMBL10784196

SCHEMBL10784196

O=C(O)c1ccc(C(=O)Oc2cc(C(=O)O)ccc2C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.63
ESR2 Q92731 1/20 0.63
KDM4E B2RXH2 6/20 0.49
TSHR P16473 4/20 0.49
ALDH1A1 P00352 4/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49
POLB P06746 1/20 0.47
POLA1 P09884 1/20 0.47
ANTXR2 P58335 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA7 P43166 1/20 0.47
TPMT P51580 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
TP53 P04637 1/20 0.44

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
SCHEMBL28489218 0.98 ESR1 (0.65) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL28096375 0.93 ESR1 (0.73) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL11196552 0.88 KDM4E (0.58) ESR1ESR2KDM4EALDH1A1POLB
SCHEMBL10782540 0.88 ESR1 (0.62) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL28087705 0.86 ESR1 (0.59) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL11275036 0.85 ESR1 (0.50) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL11193516 0.85 TSHR (0.67) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL11285516 0.84 ESR1 (0.58) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL11702442 0.81 ESR1 (0.50) ESR1ESR2KDM4ETSHRALDH1A1
SCHEMBL11273464 0.81 KDM4E (0.64) ESR1ESR2KDM4ETSHRALDH1A1

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
EP-0052927-B1 STRETCHED FILM STRUCTURE OF THE POLY-1,3-PHENYLENE TEREPHTHALATE TYPE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1987-01-07 EP disclosed
EP-0052927-A2 Stretched film structure of the poly-1,3-phenylene terephthalate type MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-06-02 EP disclosed