SCHEMBL19973856

SCHEMBL19973856

[CH2]CCC/C=C/C=C/C=C/C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
CNR2 P34972 9/20 0.34
CNR1 P21554 7/20 0.34
TRPA1 O75762 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
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
SCHEMBL28730927 1.00 SOAT1 (0.38) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL19973858 1.00 SOAT1 (0.38) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL11590168 0.97
SCHEMBL19974242 0.97
SCHEMBL19973820 0.93 SOAT1 (0.41) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL19973739 0.93 SOAT1 (0.41) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL19973821 0.93 SOAT1 (0.41) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL19973718 0.93 SOAT1 (0.41) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL19973717 0.93 SOAT1 (0.41) SOAT1ALDH1A1TSHRCNR2CNR1
SCHEMBL19973736 0.93 SOAT1 (0.41) SOAT1ALDH1A1TSHRCNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018050792-A1 PROCESS FOR PREPARING ESTERS OF 12'-APOCAROTENALS AS BUILDING BLOCKS FOR CAROTENOIDS BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050793-A1 PROCESS FOR PREPARING PHOSPHONIUM SALT ESTERS AS BUILDING BLOCKS FOR CAROTENOIDES BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050794-A1 PROCESS FOR PREPARING OF CAROTENOID MONO-ESTERS BASF SE (DE) 2018-03-22 WO disclosed
WO-2018050795-A1 PROCESS FOR PREPARING OF CAROTENOID MONO-ESTERS BASF SE (DE) 2018-03-22 WO disclosed