SCHEMBL11196552

SCHEMBL11196552

O=C(O)c1ccc(C(=O)Oc2ccc(C(=O)O)c(OC(=O)c3ccc(C(=O)O)cc3)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
ESR1 P03372 1/20 0.58
ESR2 Q92731 1/20 0.58
KMT2A Q03164 5/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPK1 P28482 2/20 0.46
POLB P06746 2/20 0.46
PARP10 Q53GL7 1/20 0.44
ELANE P08246 2/20 0.43
APEX1 P27695 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL9785919 0.90 ESR1 (0.71) KDM4EESR1ESR2KMT2AMAPT
SCHEMBL10784196 0.88 ESR1 (0.63) KDM4EESR1ESR2KMT2AMAPT
SCHEMBL11191978 0.87 MAPT (0.56) KDM4EESR1ESR2KMT2AMAPT
SCHEMBL10786832 0.86 ALDH1A1 (0.56) KDM4EESR1ESR2KMT2AMAPT
SCHEMBL28489218 0.86 ESR1 (0.65) KDM4EESR1ESR2KMT2AMAPT
SCHEMBL11193621 0.86 ESR1 (0.57) KDM4EESR1ESR2KMT2AMAPT
SCHEMBL9773525 0.85 KMT2A (0.50) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL10589091 0.83 KMT2A (0.48) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL28528136 0.83 KMT2A (0.61) KDM4EKMT2AMAPTMEN1POLB
SCHEMBL28096375 0.81 ESR1 (0.73) KDM4EESR1ESR2KMT2AMAPT

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
US-4390683-A Stretched film structure of the poly-1,3-phenylene terephthalate type MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1983-06-28 US 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