SCHEMBL11779331

SCHEMBL11779331

CCCCCONC(=O)CCl

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.45
TRPV1 Q8NER1 2/20 0.45
FAAH O00519 2/20 0.43
CNR1 P21554 1/20 0.43
EPHX1 P07099 3/20 0.41
ACHE P22303 7/20 0.40
NAAA Q02083 1/20 0.39
EPHX2 P34913 1/20 0.39
CES2 O00748 1/20 0.38
CASP2 P42575 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL11778607 0.98 CNR2 (0.47) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL11778890 0.94 CNR2 (0.42) CNR2TRPV1FAAHCNR1ACHE
SCHEMBL11775639 0.85
SCHEMBL9281603 0.82 CNR2 (0.54) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL4141685 0.82 CNR2 (0.50) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL27525565 0.82 CNR2 (0.50) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL3758968 0.80 CNR2 (0.66) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL28144752 0.80 CNR2 (0.53) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL27385830 0.80 CNR2 (0.57) CNR2TRPV1FAAHCNR1EPHX1
SCHEMBL8313083 0.78 TRPV1 (0.63) CNR2TRPV1FAAHCNR1EPHX2

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
US-3937824-A COMPOSITIONS AND METHODS OF KILLING INSECTS AND ACARIDS USING ALKOXYIMINO CARBAMOYLOXY PHOSPHORUS COMPOUNDS VELSICOL CHEMICAL CORPORATION (US) 1976-02-10 US disclosed