SCHEMBL7155158

SCHEMBL7155158

[NH]C(=Cc1ccccc1O)C(=Cc1ccccc1O)N[Co]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
TRPA1 O75762 1/20 0.36
CA2 P00918 7/20 0.35
CA12 O43570 6/20 0.35
CA9 Q16790 5/20 0.35
KDM4E B2RXH2 3/20 0.35
NFKB1 P19838 2/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
JUN P05412 1/20 0.35
NFE2L2 Q16236 1/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 2/20 0.35
CTRC Q99895 1/20 0.35
DUSP3 P51452 1/20 0.35

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
SCHEMBL9640451 0.80 TRIM24 (0.52) TRIM24TRIM33TRPA1CA2CA12
SCHEMBL11535800 0.78 TRIM24 (0.36) TRIM24TRIM33TRPA1CA2CA12
SCHEMBL11538350 0.76 TRIM24 (0.34) TRIM24TRIM33TRPA1CA2CA12
SCHEMBL11531273 0.71 ERN1 (0.54) KDM4EGAAMAPTMEN1HPGD
SCHEMBL49998 0.67
SCHEMBL29419973 0.67
SCHEMBL6058581 0.66 TRIM24 (0.45) TRIM24TRIM33TRPA1CA2CA12
SCHEMBL7172431 0.65 TRIM24 (0.54) TRIM24TRIM33TRPA1CA2CA12
SCHEMBL6035511 0.65 TRIM24 (0.54) TRIM24TRIM33TRPA1CA2CA12
SCHEMBL11721447 0.65 TRIM24 (0.54) TRIM24TRIM33TRPA1CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4164516-A COBALT-SCHIFF BASE COMPLEX AS CATALYST; AMINE, PHOSPHINE, OR PHOSPHITE COCATALYST RHONE-POULENC INDUSTRIES (FR) 1979-08-14 US claimed
JP-56007734-A None JP disclosed
EP-0992478-B1 Process for the purification and isolation of 2,3,5-trimethyl-p-benzoquinone BASF AG (DE) 2003-02-05 EP disclosed
EP-0992478-A1 Process for the purification and isolation of 2,3,5-trimethyl-p-benzoquinone BASF AKTIENGESELLSCHAFT (DE) 2000-04-12 EP disclosed
EP-0031727-B1 MEDICINAL COMPOSITIONS COMPRISING AS AN ACTIVE INGREDIENT SUBSTITUTED 1,4-BENZOQUINONES Takeda Chemical Industries, Ltd. (JP) 1986-07-30 EP disclosed
US-4559177-A HYPOTENSIVE, CARDIOTONIC AND ANTIPHYLATIC AGENTS; ANTIALLERGENS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-12-17 US disclosed
US-4495104-A PHARMACEUTICAL COMPOUNDS EFFECTIVE AGAINST HEART FAILURE, DERIODONTAL DISEASE, DIABETES; HYPOTENSIVE AND ANTIANAPHYLACTIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-01-22 US disclosed
EP-0021841-B1 2,3-DIALKOXY-1,4-QUINONE DERIVATIVES; METHOD OF PRODUCING 1,4-QUINONE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 1984-10-24 EP disclosed
US-4436753-A CARDIOVASCULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-03-13 US disclosed
EP-0031727-A2 Medicinal compositions comprising as an active ingredient substituted 1,4-benzoquinones Takeda Chemical Industries, Ltd. (JP) 1981-07-08 EP disclosed
JP-S567734-A PREPARATION OF QUINONE DERIVATIVE TAKEDA CHEM IND LTD 1981-01-27 JP disclosed
EP-0021841-A2 2,3-Dialkoxy-1,4-quinone derivatives; method of producing 1,4-quinone derivatives Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP disclosed
US-4164516-A COBALT-SCHIFF BASE COMPLEX AS CATALYST; AMINE, PHOSPHINE, OR PHOSPHITE COCATALYST RHONE-POULENC INDUSTRIES (FR) 1979-08-14 US disclosed