SCHEMBL11323536

SCHEMBL11323536

C=CCCCCCC(=O)NCCCC

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.62
EPHX2 P34913 2/20 0.60
CNR1 P21554 5/20 0.59
SLC6A5 Q9Y345 2/20 0.59
KDM4E B2RXH2 1/20 0.56
LPAR1 Q92633 1/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.55
CNR2 P34972 2/20 0.55
TRPV1 Q8NER1 1/20 0.55
MEN1 O00255 1/20 0.55
MAPT P10636 1/20 0.55
ALOX12 P18054 1/20 0.55
BLM P54132 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.55

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
SCHEMBL15199789 1.00 FAAH (0.62) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL11328619 0.95 EPHX2 (0.68) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL4708351 0.95 EPHX2 (0.68) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL13413667 0.95 EPHX2 (0.68) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL11326162 0.95 EPHX2 (0.68) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL28642457 0.95 EPHX2 (0.68) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL13413661 0.95 EPHX2 (0.68) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL22199432 0.93 FAAH (0.67) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL24481875 0.92 CASP2 (0.62) FAAHEPHX2CNR1SLC6A5KDM4E
SCHEMBL22588868 0.91 FAAH (0.64) FAAHEPHX2CNR1SLC6A5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 US disclosed