SCHEMBL8092281

SCHEMBL8092281

C=CN(CCCCCCCCCC)C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.44
ZDHHC2 Q9UIJ5 2/20 0.44
FAAH O00519 1/20 0.42
DNM1 Q05193 3/20 0.38
TSHR P16473 5/20 0.38
EPHX1 P07099 4/20 0.38
CES2 O00748 3/20 0.37
CES1 P23141 3/20 0.37
EPHX2 P34913 2/20 0.36
ALDH1A1 P00352 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
GPR84 Q9NQS5 1/20 0.35

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
SCHEMBL12512731 1.00 ZDHHC20 (0.44) ZDHHC20ZDHHC2FAAHDNM1TSHR
SCHEMBL927505 0.92 CA12 (0.39) ZDHHC20ZDHHC2FAAHTSHREPHX1
SCHEMBL7938767 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL7795037 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL7937851 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL8727760 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL8724190 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL7938909 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL7929800 0.92 ZDHHC20 (0.33) ZDHHC20ZDHHC2FAAHALDH1A1
SCHEMBL177842 0.89 ALDH1A1 (0.35) ZDHHC20ZDHHC2ALDH1A1

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
EP-1050565-A2 Method of hydrophobisation and preparations for carrying out said method BASF AKTIENGESELLSCHAFT (DE) 2000-11-08 EP disclosed