SCHEMBL23930718

SCHEMBL23930718

CCCCCCCCCCCCCCCCCCCC(CC)OC(=O)CC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
LMNA P02545 3/20 0.47
ALDH1A1 P00352 1/20 0.47
NAAA Q02083 1/20 0.47
PRKCA P17252 2/20 0.44
PRKCD Q05655 2/20 0.44
PRKCE Q02156 1/20 0.44
PRKCQ Q04759 1/20 0.44
FAAH O00519 4/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
ZDHHC7 Q9NXF8 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
SCHEMBL3712813 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL6904773 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL13415721 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL28951564 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL4816642 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL6906747 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL29223341 1.00 MAPT (0.50) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL7117627 0.98 MAPT (0.47) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL27534069 0.95 MAPT (0.46) MAPTMAPK1LMNAALDH1A1NAAA
SCHEMBL28344567 0.94 MEN1 (0.42) MAPTMAPK1LMNAALDH1A1NAAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021214360-A1 USE OF (Z)-3-HEXENYL ESTERS AND METHOD FOR PROTECTING PLANTS AGAINST PESTS UNIVERSITAT POLITÈCNICA DE VALÈNCIA (ES) 2021-10-28 WO claimed
WO-2021214360-A1 USE OF (Z)-3-HEXENYL ESTERS AND METHOD FOR PROTECTING PLANTS AGAINST PESTS UNIVERSITAT POLITÈCNICA DE VALÈNCIA (ES) 2021-10-28 WO disclosed