SCHEMBL9531499

SCHEMBL9531499

C/C=C/C=C/C(=O)NCCCC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.47
CNR1 P21554 6/20 0.47
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
ZDHHC20 Q5W0Z9 3/20 0.47
ZDHHC2 Q9UIJ5 2/20 0.47
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
EGFR P00533 1/20 0.44
EPHX1 P07099 2/20 0.44

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
SCHEMBL9531511 1.00 CNR2 (0.47) CNR2CNR1PPARGPPARDPPARA
SCHEMBL9111856 0.86 ZDHHC20 (0.48) CNR2CNR1ZDHHC20ZDHHC2MAPT
SCHEMBL9111853 0.86 ZDHHC20 (0.48) CNR2CNR1ZDHHC20ZDHHC2MAPT
SCHEMBL3701812 0.86 ZDHHC20 (0.52) ZDHHC20ZDHHC2MAPTHTTEGFR
SCHEMBL3701815 0.86 ZDHHC20 (0.52) ZDHHC20ZDHHC2MAPTHTTEGFR
SCHEMBL1395631 0.83 ZDHHC20 (0.57) ZDHHC20ZDHHC2MAPTHTTEGFR
SCHEMBL1395670 0.83 ZDHHC20 (0.57) ZDHHC20ZDHHC2MAPTHTTEGFR
SCHEMBL4870992 0.83 ZDHHC20 (0.57) ZDHHC20ZDHHC2MAPTHTTEGFR
SCHEMBL4886505 0.80 CNR1 (0.68) CNR2CNR1
SCHEMBL19272321 0.80 CNR2 (0.46) CNR2CNR1PPARGPPARDPPARA

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-0540209-A1 Imidazole derivatives and pharmaceutical compositions containing the same THE UPJOHN COMPANY (US) 1993-05-05 EP disclosed