SCHEMBL17860700

SCHEMBL17860700

CCCC(C)OC(=O)C(C)CI

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.41
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 2/20 0.31
CYP3A4 P08684 2/20 0.31
TSHR P16473 2/20 0.31
NFKB1 P19838 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31

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
SCHEMBL9012298 0.85 FAAH (0.44) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL14764032 0.83 FAAH (0.43) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL17860866 0.83 MAPT (0.39) FAAH
SCHEMBL17860711 0.81 FAAH (0.39) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL17860703 0.81 PRKCA (0.41) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL17878541 0.80 FAAH (0.41) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL880134 0.79 FAAH (0.46) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL14296417 0.79 FAAH (0.46) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL14296416 0.79 FAAH (0.46) FAAHCNR1CNR2CHRM1AKR1A1
SCHEMBL19115181 0.78 FAAH (0.56) FAAHCNR1CNR2CA1FDPS

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-2016100578-A2 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (US) 2016-06-23 WO disclosed