SCHEMBL28200818

SCHEMBL28200818

CCCCCCCCC/C=C\CCCCCCCC(=O)NCC

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.78
EPHX2 P34913 2/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
CNR1 P21554 2/20 0.67
ALDH1A1 P00352 2/20 0.67
HPGD P15428 2/20 0.67
SLC6A5 Q9Y345 2/20 0.67
TRPV1 Q8NER1 1/20 0.67
MAPT P10636 1/20 0.67
ALOX12 P18054 1/20 0.67
BLM P54132 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
KDM4E B2RXH2 1/20 0.63
LPAR1 Q92633 1/20 0.63

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
SCHEMBL25847144 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL379156 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL18240167 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL4155101 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL379158 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL23027722 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL18240169 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL16599896 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL2476433 1.00 FAAH (0.78) FAAHEPHX2MEN1KMT2ACNR1
SCHEMBL6287721 0.95 MEN1 (0.77) FAAHMEN1KMT2ACNR1ALDH1A1

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-104661526-B Clomazone preparation FMC有限公司 2018-01-09 CN disclosed