SCHEMBL9889648

SCHEMBL9889648

C=CC(=O)NCC(O)COCCCCOCC(O)CNC(=O)C=C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
USP2 O75604 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
HTT P42858 1/20 0.35
PLA2G2C Q5R387 3/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
LPAR5 Q9H1C0 1/20 0.34
KDM4E B2RXH2 1/20 0.32
TLR2 O60603 2/20 0.32
TGM2 P21980 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
SCHEMBL9889644 0.93 TSHR (0.43) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL18755127 0.92 ZDHHC20 (0.41) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL16379835 0.91 ZDHHC20 (0.46) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL18755126 0.90 CYP1A2 (0.41) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL22056017 0.89 TSHR (0.44) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL28338477 0.88 ALDH1A1 (0.39) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL22898883 0.85 CYP1A2 (0.35) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL18755150 0.85 ALDH1A1 (0.37) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL18643192 0.84 TDP1 (0.41) TSHRALDH1A1MAPK1TDP1CYP3A4
SCHEMBL508742 0.83 ZDHHC20 (0.31) TSHRALDH1A1MAPK1TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3017953-B1 INKJET PRINTER AND IMAGE FORMATION METHOD KONICA MINOLTA INC (JP) 2020-05-27 EP disclosed
EP-2363437-B1 Ink composition, ink set and image forming method FUJIFILM CORP (JP) 2018-08-08 EP disclosed
US-9714353-B2 Ink composition, ink set, and image formation method FUJIFILM CORPORATION (JP) 2017-07-25 US disclosed
EP-2977413-B1 INK COMPOSITION, INK SET, AND IMAGE FORMATION METHOD FUJIFILM CORP (JP) 2017-04-19 EP disclosed
EP-2902417-B1 CURABLE RESIN COMPOSITION, WATER-SOLUBLE INK COMPOSITION, INK SET, AND IMAGE FORMATION METHOD FUJIFILM CORP (JP) 2017-01-11 EP disclosed
US-9481179-B2 Inkjet printer and image formation method Konica Minolta, Inc. (JP) 2016-11-01 US disclosed
US-9481179-B2 Inkjet printer and image formation method Konica Minolta, Inc. (JP) 2016-11-01 US disclosed
US-9458337-B2 Curable resin composition, water-soluble ink composition, ink set, and image-forming method FUJIFILM CORPORATION (JP) 2016-10-04 US disclosed
US-9371460-B2 Photopolymerization method, ink set, ink composition, and water-soluble biimidazole FUJIFILM CORPORATION (JP) 2016-06-21 US disclosed
US-20160152034-A1 INKJET PRINTER AND IMAGE FORMATION METHOD Konica Minolta, Inc. (JP) 2016-06-02 US disclosed
US-8317312-B2 Ink composition, ink set and image forming process FUJIFILM CORPORATION (JP) 2012-11-27 US disclosed
US-20120249701-A1 BLACK INK COMPOSITION, INK SET, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-10-04 US disclosed
US-20120200651-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-08-09 US disclosed
US-20120141679-A1 INK COMPOSITION, INK SET, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-06-07 US disclosed
US-20110249055-A1 INK COMPOSITION, METHOD OF PRODUCING THE SAME, INK SET, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-10-13 US disclosed
WO-2011122356-A1 INK COMPOSITION AND METHOD FOR PRODUCING THE SAME, INK SET, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-10-06 WO disclosed
US-20110234690-A1 INK COMPOSITION, INK SET AND IMAGE FORMING PROCESS FUJIFILM CORPORATION (JP) 2011-09-29 US disclosed
US-20110234684-A1 IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-09-29 US disclosed
EP-2363437-A2 Ink composition, ink set and image forming method Fujifilm Corporation (JP) 2011-09-07 EP disclosed
US-20110205291-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-08-25 US disclosed