SCHEMBL3074650

SCHEMBL3074650

O=C(c1cccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c1)c1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.63
PYGM P11217 5/20 0.58
HPSE Q9Y251 2/20 0.55
GALK1 P51570 1/20 0.53
CASP6 P55212 1/20 0.53
MCL1 Q07820 1/20 0.53
PLEC Q15149 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
PYGL P06737 4/20 0.53
AKR1C3 P42330 2/20 0.53
CDC25A P30304 1/20 0.53
CDC25B P30305 1/20 0.53
HSD17B10 Q99714 1/20 0.53
KDM4E B2RXH2 1/20 0.51
KMO O15229 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
SCHEMBL4472633 0.92 POLB (0.70) POLBPYGMHPSEGALK1CASP6
SCHEMBL3085366 0.89 POLB (0.76) POLBPYGMHPSEGALK1CASP6
SCHEMBL3080414 0.87 POLB (0.77) POLBPYGMHPSEGALK1CASP6
SCHEMBL3073043 0.87 POLB (0.62) POLBPYGMHPSEGALK1CASP6
SCHEMBL28634306 0.84 POLB (0.61) POLBPYGMHPSEGALK1CASP6
SCHEMBL29777466 0.84 POLB (0.63) POLBPYGMHPSEGALK1CASP6
2-Benzoylbenzoic Acid SCHEMBL27616766 0.84 AKR1C3 (0.65) POLBHPSEAKR1C3KDM4EKMO
SCHEMBL7057386 0.84 POLB (0.63) POLBPYGMHPSEGALK1CASP6
SCHEMBL3068910 0.83 POLB (0.85) POLBPYGMHPSEGALK1CASP6
SCHEMBL30237450 0.83 POLB (0.85) POLBPYGMHPSEGALK1CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100226016-A1 LIGHT-SHIELDING FILM NIPPON SHOKUBAI CO., LTD. (JP) 2010-09-09 US disclosed
EP-2183622-A1 LIGHT-SHIELDING FILM Nippon Shokubai Co., Ltd. (JP) 2010-05-12 EP disclosed
US-20090280339-A1 POLYIMIDE FILM, POLYIMIDE METAL LAMINATE USING SAME, AND METHOD FOR MANUFACTURING SAME MITSUI CHEMICALS ,INC. (JP) 2009-11-12 US disclosed
WO-2009014264-A1 LIGHT-SHIELDING FILM NIPPON SHOKUBAI CO., LTD. (JP) 2009-01-29 WO disclosed
US-20080299402-A1 Polyimide film, polyimide metal laminate and process for producing the same MITSUI CHEMICALS, INC. (JP) 2008-12-04 US disclosed
US-20040096679-A1 Metal laminate MITSUI CHEMICALS, INC. (JP) 2004-05-20 US disclosed
EP-1420048-A2 Metal laminate Mitsui Chemicals, Inc. (JP) 2004-05-19 EP disclosed