SCHEMBL7966772

SCHEMBL7966772

NC(=O)CCCNC(=O)C(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 9/20 0.57
CNR2 P34972 6/20 0.57
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL8376195 0.79 NAAA (0.56) CNR1CNR2
SCHEMBL8373891 0.79 NAAA (0.56) CNR1CNR2
SCHEMBL8374187 0.79 NAAA (0.56) CNR1CNR2
SCHEMBL9461596 0.78 CNR1 (0.62) CNR1CNR2CYP3A4CYP2D6CYP2C19
Dimethylamine SCHEMBL9167323 0.75 CNR1 (0.59) CNR1CNR2HTTSMN1; SMN2
SCHEMBL9461958 0.74 CNR1 (0.57) CNR1CNR2CYP3A4CYP2D6CYP2C19
SCHEMBL28041163 0.73 CNR1 (1.00) CNR1CNR2HTTSMN1; SMN2
SCHEMBL7595831 0.73 CNR1 (0.59) CNR1CNR2HTTSMN1; SMN2
SCHEMBL9854656 0.70 CNR1 (0.45) CNR1CNR2
SCHEMBL20803506 0.70 CNR1 (0.69) CNR1CNR2HTTSMN1; SMN2

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-2001002364-A1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 2001-01-11 WO disclosed