SCHEMBL3407482

SCHEMBL3407482

C=C(C)C(=O)OCC(O)CC(C)N(C)C

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
THRB P10828 1/20 0.36
CHRNB2 P17787 7/20 0.35
CHRNA4 P43681 7/20 0.35
CHRNB4 P30926 5/20 0.35
CHRNA3 P32297 5/20 0.35
ALDH1A1 P00352 4/20 0.34
USP2 O75604 2/20 0.34
CYP3A4 P08684 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL2788400 0.84 TSHR (0.64) TSHRTHRBCHRNB2CHRNA4CHRNB4
SCHEMBL19519756 0.82 TSHR (0.68) TSHRTHRBALDH1A1USP2CYP3A4
Hydrochloric Acid SCHEMBL1362589 0.82 TSHR (0.62) TSHRTHRBCHRNB2CHRNA4CHRNB4
SCHEMBL94906 0.80 TSHR (0.68) TSHRTHRBALDH1A1USP2CYP3A4
SCHEMBL28262918 0.78 TSHR (0.56) TSHRTHRBALDH1A1USP2CYP3A4
SCHEMBL8763307 0.78 TSHR (0.56) TSHRTHRBALDH1A1USP2CYP3A4
SCHEMBL19998240 0.78 TSHR (0.65) TSHRTHRBALDH1A1USP2CYP3A4
SCHEMBL1254890 0.77 TSHR (0.55) TSHRTHRBALDH1A1HPGDSMN1; SMN2
Trimethylammonium SCHEMBL5242715 0.77 TSHR (0.64) TSHRTHRBALDH1A1MAPTMAPK1
SCHEMBL3404229 0.77 TSHR (0.55) TSHRTHRBCHRNB2CHRNA4CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2252664-B1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS XEROX CORP (US) 2018-12-05 EP disclosed
EP-2260081-B1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME XEROX CORP (US) 2014-11-26 EP disclosed
US-8815394-B2 Encapsulated nanoscale particles of organic pigments XEROX CORPORATION (US) 2014-08-26 US disclosed
US-8287637-B2 Silica encapsulated organic nanopigments and method of making same XEROX CORPORATION (US) 2012-10-16 US disclosed
EP-2260081-A1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME Xerox Corporation (US) 2010-12-15 EP disclosed
EP-2252664-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS Xerox Corporation (US) 2010-11-24 EP disclosed
WO-2009148687-A1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME XEROX CORPORATION (US) 2009-12-10 WO disclosed
WO-2009126388-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS XEROX CORPORATION (US) 2009-10-15 WO disclosed
US-20090246674-A1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME XEROX CORPORATION (US) 2009-10-01 US disclosed
US-20090227711-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS XEROX CORPORATION (US) 2009-09-10 US disclosed
WO-2008057409-A2 SANITIZING SURFACES SEARETE LLC (US) 2008-05-15 WO disclosed
US-20070254015-A1 Sanitizing surfaces SEARETE LLC, A LIMITED LIABILITY CORPORATION OF THE STATE OF DELAWARE 2007-11-01 US disclosed
EP-0140854-A2 Bacteria repellent surfaces ALFA-LAVAL AGRI INTERNATIONAL AB (SE) 1985-05-08 EP disclosed
WO-1985001507-A1 BACTERIA REPELLENT SURFACES ALFA-LAVAL AGRI INTERNATIONAL AB (SE) 1985-04-11 WO disclosed
US-4174152-A Electrochromic devices with polymeric electrolytes AMERICAN CYANAMID COMPANY (US) 1979-11-13 US disclosed
US-4009684-A Water soluble polymers useful in the preparation of novel animal litter NATIONAL PATENT DEVELOPMENT CORPORATION (US) 1977-03-01 US disclosed
US-4003991-A WATER SOLUBLE ACRYLIC, 2-ALKENAMIDE, OR ETHYLENIMINE POLYMER; TOPICAL MEDICAMENTS NATIONAL PATENT DEVELOPMENT CORPORATION (US) 1977-01-18 US disclosed