SCHEMBL1228648

SCHEMBL1228648

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

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.36
TSHR P16473 2/20 0.36
NFKB1 P19838 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CA2 P00918 1/20 0.34
CA1 P00915 4/20 0.32
GAA P10253 1/20 0.30

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
SCHEMBL5149610 1.00 CYP3A4 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL1230706 0.95 CYP3A4 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL1229405 0.95 CYP3A4 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL1230037 0.95 CYP3A4 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL1230925 0.95 CYP3A4 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL1229982 0.95 CYP3A4 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL230829 0.95 TSHR (0.39) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL5151546 0.93 TSHR (0.37) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL1230753 0.93 TSHR (0.37) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL5317232 0.91 CYP3A4 (0.38) CYP3A4TSHRNFKB1NPSR1CA2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1749859-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-09-11 EP disclosed
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
EP-1749858-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-04-03 EP disclosed
EP-1749857-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2019-03-27 EP disclosed
US-20160174385-A1 METHOD OF PRODUCING CONDUCTIVE CURED MATERIAL AND CONDUCTIVE CURED MATERIAL, AND METHOD OF CURING PULSE LIGHT-CURABLE COMPOSITION AND PULSE LIGHT-CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2016-06-16 US disclosed
EP-3020767-A1 PRODUCTION METHOD FOR ELECTRICALLY CONDUCTIVE CURED ARTICLE, ELECTRICALLY CONDUCTIVE CURED ARTICLE, CURING METHOD FOR PULSED LIGHT CURING COMPOSITION, AND PULSED LIGHT CURING COMPOSITION Cemedine Co., Ltd. (JP) 2016-05-18 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-20080033087-A1 Polyoxyalkylene glycol or a methacrylate polymer containing a crosslinkable silicon group; a titaniuim chelate of an alkyl acetoacetoate or derivative; and an amide wax thickener; highly curable KANEKA CORPORATION (JP) 2008-02-07 US disclosed
US-20070287780-A1 Curable Composition KANEKA CORPORATION (JP) 2007-12-13 US disclosed
US-20070219299-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 2007-09-20 US disclosed
EP-1752496-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-14 EP disclosed
EP-1749857-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-07 EP disclosed
EP-1749859-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-07 EP disclosed
EP-1749858-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2007-02-07 EP 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