SCHEMBL11087291

SCHEMBL11087291

CCCCCCCC/C=C/C(CCCCCCCOC(C)=O)OC(C)=O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
PRKCA P17252 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PDE4D Q08499 2/20 0.43
FAAH O00519 1/20 0.43
GALR3 O60755 1/20 0.42
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9856232 0.92 PRKCA (0.46) ALDH1A1PRKCAMEN1KMT2APDE4D
SCHEMBL29259205 0.92 MEN1 (0.50) MEN1KMT2APDE4DGALR3CYP3A4
SCHEMBL29094957 0.88 MEN1 (0.45) MEN1KMT2APDE4DGALR3CYP3A4
SCHEMBL30368256 0.86 GALR3 (0.47) MEN1KMT2APDE4DGALR3
SCHEMBL500451 0.86 MEN1 (0.46) PRKCAMEN1KMT2APDE4DFAAH
SCHEMBL500452 0.86 MEN1 (0.46) PRKCAMEN1KMT2APDE4DFAAH
SCHEMBL31508680 0.83 ALDH1A1 (0.47) ALDH1A1PRKCAMEN1KMT2AFAAH
SCHEMBL11411944 0.83 GALR3 (0.40) ALDH1A1PRKCAMEN1KMT2APDE4D
SCHEMBL11411941 0.83 GALR3 (0.40) ALDH1A1PRKCAMEN1KMT2APDE4D
SCHEMBL7939398 0.82 PRKCA (0.46) ALDH1A1PRKCAMEN1KMT2AFAAH

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-0099572-A1 Disproportionation of functional olefins PHILLIPS PETROLEUM COMPANY (US) 1984-02-01 EP disclosed