SCHEMBL10180988

SCHEMBL10180988

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC1=CCCC=C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.55
ALDH1A1 P00352 4/20 0.55
MAPT P10636 4/20 0.55
HPGD P15428 4/20 0.55
CNR2 P34972 4/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TRPV1 Q8NER1 3/20 0.55
CYP3A4 P08684 2/20 0.55
ALOX15 P16050 2/20 0.55
PSMB11 A5LHX3 1/20 0.55
PSMA7 O14818 1/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
GAA P10253 1/20 0.55
CYP2C9 P11712 1/20 0.55
PSMB1 P20618 1/20 0.55
PSMA1 P25786 1/20 0.55
PSMA2 P25787 1/20 0.55
PSMA3 P25788 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
SCHEMBL18240151 0.72 SOAT2 (0.86) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL18240149 0.72 SOAT2 (0.86) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL3154754 0.72 CNR1 (0.71) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL3634730 0.72 CNR1 (0.71) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL3634728 0.72 CNR1 (0.71) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL1395702 0.71 CNR1 (1.00) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL157919 0.71 CNR1 (1.00) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL6705877 0.71 CNR1 (1.00) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL5528061 0.70 CNR1 (0.73) CNR1ALDH1A1MAPTHPGDCNR2
SCHEMBL15007736 0.70 CNR1 (0.90) CNR1ALDH1A1MAPTHPGDCNR2

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
EP-1636335-B1 COMPOSITIONS AND METHODS FOR INHIBITING AN ISOFORM OF HUMAN MANGANESE SUPEROXIDE DISMUTASE MITO TEK LLC (US) 2012-07-11 EP claimed