SCHEMBL28778155

SCHEMBL28778155

C=CC(=O)NCCCC(C)(C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
ACLY P53396 1/20 0.46
GAA P10253 1/20 0.46
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
GUCY1A1 Q02108 1/20 0.40
GUCY1B1 Q02153 1/20 0.40
TGM2 P21980 6/20 0.39
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
PPARA Q07869 2/20 0.35
MAPT P10636 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
SCHEMBL28360724 0.89 ZDHHC20 (0.47) ZDHHC20ZDHHC2ACLYGAAALDH1A1
Ammonia Solution, Strong SCHEMBL27581904 0.81 ZDHHC20 (0.49) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL463467 0.80 ZDHHC20 (0.47) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL22367606 0.79 ZDHHC20 (0.53) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL4344395 0.78 ZDHHC20 (0.61) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL22951068 0.77 KDM4E (0.54) ACLYALDH1A1TSHRMAPK1ACACB
SCHEMBL28449678 0.77 ZDHHC20 (0.51) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL24119207 0.76 ZDHHC20 (0.65) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL4653768 0.76 ZDHHC20 (0.55) ZDHHC20ZDHHC2GAAALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL29386805 0.76 ZDHHC20 (0.59) ZDHHC20ZDHHC2GAAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101356062-A Ink jet recording medium and method for producing the same FUJIFILM CORP (JP) 2009-01-28 CN disclosed