SCHEMBL1230516

SCHEMBL1230516

CC(C)[O-].CC(C)[O-].CC(C)[O-].CCC(C(C)=O)C(=O)[O-].[Zr+4]

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
NFKB1 P19838 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
CA1 P00915 4/20 0.34
CA2 P00918 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL1230462 1.00 CYP3A4 (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL1229335 1.00 CYP3A4 (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL2156822 0.95 TSHR (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL1132735 0.95 TSHR (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL1230379 0.95 CYP3A4 (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL10982849 0.95 CYP3A4 (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL407252 0.95 TSHR (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL342872 0.95 CYP3A4 (0.34) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL209175 0.93 CYP3A4 (0.39) CYP3A4TSHRNFKB1NPSR1CA1
SCHEMBL1229436 0.91 CYP3A4 (0.37) CYP3A4TSHRNFKB1NPSR1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1746134-B1 CURABLE COMPOSITION WITH IMPROVED CURABILITY AND ADHESIVENESS KANEKA CORP (JP) 2019-09-04 EP disclosed
EP-1746135-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-05-29 EP disclosed
US-7973108-B2 Curable composition KANEKA CORPORATION (JP) 2011-07-05 US disclosed
US-7910681-B2 Curable composition having improved adhesion KANEKA CORPORATION (JP) 2011-03-22 US disclosed
US-7893170-B2 Curable composition having improved curability and adhesion KANEKA CORPORATION (JP) 2011-02-22 US disclosed
US-20080319152-A1 Curable Composition KANEKA CORPORATION (JP) 2008-12-25 US disclosed
US-20080194773-A1 Polysiloxane from silanetriol group, a titanium, aluminum or a zirconium catalyst, and a low molecular weight compound containing a hydrolyzable silicon group; sealants, adhesives KANEKA CORPORATION (JP) 2008-08-14 US disclosed
US-20080076878-A1 Organic polymer having a silane tiol group, a titanium, aluminum or a zirconium catalyst, and a low molecular weight compound containing a hydrolyzable silicon group; sealants, adhesives KANEKA CORPORATION (JP) 2008-03-27 US disclosed
EP-1746134-A1 CURABLE COMPOSITION WITH IMPROVED CURABILITY AND ADHESIVENESS Kaneka Corporation (JP) 2007-01-24 EP disclosed
EP-1746133-A1 CURABLE COMPOSITION IMPROVED IN ADHESIVENESS Kaneka Corporation (JP) 2007-01-24 EP disclosed
EP-1746135-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-01-24 EP disclosed