SCHEMBL784665

SCHEMBL784665

C=CC(=O)NCCCOC(=O)C(C)C(C)C=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
TGM2 P21980 10/20 0.40
TSHR P16473 5/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL784470 0.91 ZDHHC20 (0.40) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL26478818 0.84 ZDHHC20 (0.53) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL784546 0.81 TSHR (0.39) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL2608177 0.80 ZDHHC20 (0.56) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL2608197 0.78 ZDHHC20 (0.59) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL20146719 0.76 ZDHHC20 (0.55) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL23789983 0.76 ZDHHC20 (0.47) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL26478820 0.76 ZDHHC20 (0.47) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL784556 0.75 ZDHHC20 (0.42) ZDHHC20ZDHHC2TGM2TSHRALDH1A1
SCHEMBL784461 0.75 TSHR (0.36) ZDHHC20ZDHHC2TGM2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8708474-B2 Ink composition, ink set and image forming method FUJIFILM CORPORATION (JP) 2014-04-29 US disclosed
US-8668322-B2 2014-03-11 US disclosed
US-20120069083-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-03-22 US disclosed