SCHEMBL19686832

SCHEMBL19686832

CCCCCCCCCCCCCCCC(=O)NCCCCCCOC(C)C

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.59
FAAH O00519 6/20 0.57
NAAA Q02083 1/20 0.56
DNM1 Q05193 2/20 0.54
EPHX2 P34913 3/20 0.52
SLC6A5 Q9Y345 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48

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
SCHEMBL26709266 1.00 CASP2 (0.59) CASP2FAAHNAAADNM1EPHX2
SCHEMBL25730796 0.90 CASP2 (0.62) CASP2FAAHNAAAMEN1KMT2A
SCHEMBL22857458 0.90 FAAH (0.57) CASP2FAAHNAAADNM1EPHX2
SCHEMBL20869876 0.86 ACHE (0.52) CASP2FAAHEPHX2
SCHEMBL26700973 0.86 CNR1 (0.47) CASP2FAAHEPHX2MEN1KMT2A
SCHEMBL26700975 0.86 CNR1 (0.47) CASP2FAAHEPHX2MEN1KMT2A
SCHEMBL22790860 0.85 TLR2 (0.46) FAAHDNM1EPHX2CNR1CNR2
SCHEMBL22794195 0.85 TLR2 (0.46) FAAHDNM1EPHX2CNR1CNR2
SCHEMBL22692705 0.85 TSHR (0.46) CASP2FAAHNAAAL3MBTL1MEN1
SCHEMBL26700966 0.84 ALDH1A1 (0.46) L3MBTL1KMT2ACNR1CNR2

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
WO-2017139697-A9 BACTERIA ENGINEERED TO TREAT DISEASES ASSOCIATED WITH HYPERAMMONEMIA SYNLOGIC, INC. (US) 2017-12-07 WO disclosed