SCHEMBL10039110

SCHEMBL10039110

C=C(/C=C\C=C/C)CC(=O)NNI

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
CNR2 P34972 6/20 0.32
CNR1 P21554 4/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL25018313 0.79 CNR2 (0.34) LMNAMAPK1HTTCNR2CNR1
SCHEMBL7033746 0.75 CNR2 (0.36) LMNAMAPK1HTTCNR2CNR1
SCHEMBL15727926 0.75 CNR2 (0.36) LMNAMAPK1HTTCNR2CNR1
SCHEMBL17469583 0.67 SOAT1 (0.46) MAPK1CNR2CNR1PPARGPPARD
SCHEMBL24323094 0.66 CASP2 (0.37) CNR2CNR1PPARGPPARDPPARA
SCHEMBL13068893 0.66 CNR2 (0.33) CNR2CNR1PPARGPPARDPPARA
SCHEMBL7795305 0.65
SCHEMBL2631141 0.65
SCHEMBL14767422 0.65 CNR2 (0.30) CNR2CNR1PPARGPPARDPPARA
SCHEMBL18522446 0.63 ALDH1A1 (0.40) MAPK1CNR2CNR1PPARGPPARD

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-2012017973-A1 PEST CONTROL COMPOSITION 住友化学株式会社 (JP) 2012-02-09 WO disclosed