SCHEMBL6666460

SCHEMBL6666460

O=C(O)c1ccc2cc(C(=O)O)ccc2c1.[Cu]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.65
TSHR P16473 2/20 0.58
TP53 P04637 1/20 0.58
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA4 P22748 2/20 0.54
CA6 P23280 2/20 0.54
CA7 P43166 2/20 0.54
CA9 Q16790 2/20 0.54
CA14 Q9ULX7 2/20 0.54
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
PTGS2 P35354 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54

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
SCHEMBL18758 0.97 KDM4E (0.68) KDM4ETSHRTP53CA12CA1
SCHEMBL6916181 0.97 KDM4E (0.68) KDM4ETSHRTP53CA12CA1
SCHEMBL29594563 0.97 KDM4E (0.68) KDM4ETSHRTP53CA12CA1
SCHEMBL29359975 0.97 KDM4E (0.68) KDM4ETSHRTP53CA12CA1
Bicarbonate SCHEMBL6557215 0.94 KDM4E (0.65) KDM4ETSHRTP53CA12CA1
Bromide SCHEMBL8758652 0.94 KDM4E (0.65) KDM4ETSHRTP53CA12CA1
Hydrochloric Acid SCHEMBL1681545 0.94 KDM4E (0.65) KDM4ETSHRTP53CA12CA1
SCHEMBL1886411 0.94 KDM4E (0.65) KDM4ETSHRTP53CA12CA1
SCHEMBL20942846 0.94 KDM4E (0.65) KDM4ETSHRTP53CA12CA1
SCHEMBL11658600 0.94 KDM4E (0.65) KDM4ETSHRTP53CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727608-B1 Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO LTD (JP) 2004-09-01 EP disclosed
US-5998647-A BIPHENYL DICARBOXYLIC ACID COPPER COMPLEX OSAKA GAS CO., LTD. (JP) 1999-12-07 US disclosed
US-5862796-A Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO., LTD. (JP) 1999-01-26 US disclosed
EP-0727608-A2 Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO., LTD. (JP) 1996-08-21 EP disclosed