SCHEMBL407252

SCHEMBL407252

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

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.34
CYP3A4 P08684 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
SCHEMBL2156822 1.00 TSHR (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL1132735 1.00 TSHR (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL1230516 0.95 CYP3A4 (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL1230379 0.95 CYP3A4 (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL1229335 0.95 CYP3A4 (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL342872 0.95 CYP3A4 (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL1230462 0.95 CYP3A4 (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL10982849 0.95 CYP3A4 (0.34) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL2157296 0.93 TSHR (0.33) TSHRCYP3A4NFKB1NPSR1CA1
SCHEMBL230829 0.93 TSHR (0.39) TSHRCYP3A4NFKB1NPSR1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12091547-B2 Silicone elastomer composition TESA SE (DE) 2024-09-17 US claimed
US-11511230-B2 High separation performance polydialkylsiloxane pervaporation membranes PROMERUS, LLC (US) 2022-11-29 US claimed
US-20220162448-A1 SILICONE ELASTOMER COMPOSITION TESA SE (DE) 2022-05-26 US claimed
EP-3110855-B1 POLYMERIZATION INITIATOR SYSTEM SUITABLE FOR CURE AT LOW TEMPERATURE ELANTAS PDG INC (US) 2020-05-27 EP claimed
US-20200148830-A1 SILICONE ELASTOMER COMPOSITION TESA SE (DE) 2020-05-14 US claimed
US-20190351372-A1 HIGH SEPARATION PERFORMANCE POLYDIALKYLSILOXANE PERVAPORATION MEMBRANES PROMERUS, LLC (US) 2019-11-21 US claimed
EP-3555211-A1 SILICONE ELASTOMER COMPOSITION TESA SE (DE) 2019-10-23 EP claimed
EP-3555212-A1 SILICONE ELASTOMER COMPOSITION tesa SE (DE) 2019-10-23 EP claimed
WO-2018109425-A1 SILICONE ELASTOMER COMPOSITION FORMFORMFORM LTD (GB) 2018-06-21 WO claimed
WO-2018109493-A1 SILICONE ELASTOMER COMPOSITION FORMFORMFORM LTD (GB) 2018-06-21 WO claimed
US-8236203-B2 Corrosion protection coatings and methods of making the same HIHARA LLOYD H (US) 2012-08-07 US claimed
WO-2011084346-A2 CORROSION PROTECTION COATINGS AND METHODS OF MAKING THE SAME UNIVERSITY OF HAWAII (US) 2011-07-14 WO claimed
EP-1477532-B1 Spherical silica-titania-based fine particles surface-treated with silane, production process therefor, and external additive for electrostatically charged image developing toner using same SHINETSU CHEMICAL CO (JP) 2011-05-25 EP claimed
US-7910681-B2 Curable composition having improved adhesion KANEKA CORPORATION (JP) 2011-03-22 US claimed
US-7893170-B2 Curable composition having improved curability and adhesion KANEKA CORPORATION (JP) 2011-02-22 US claimed
US-20110024688-A1 CORROSION PROTECTION COATINGS AND METHODS OF MAKING THE SAME HIHARA LLOYD H 2011-02-03 US claimed
US-7763673-B2 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) 2010-07-27 US claimed
US-7144628-B2 Spherical silica-titania-based fine particles surface-treated with silane, production process therefor, and external additive for electrostatically charged image developing toner using same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2006-12-05 US claimed
US-20040229040-A1 Spherical silica-titania-based fine particles surface-treated with silane, production process therefor, and external additive for electrostatically charged image developing toner using same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-11-18 US claimed
EP-1477532-A2 Spherical silica-titania-based fine particles surface-treated with silane, production process therefor, and external additive for electrostatically charged image developing toner using same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-11-17 EP claimed