SCHEMBL5084469

SCHEMBL5084469

C=CCCC=CCC=CCC=CCCCCCCCC

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.62
TRPV1 Q8NER1 1/20 0.55
ALDH1A1 P00352 4/20 0.53
KDM4E B2RXH2 3/20 0.53
F7 P08709 3/20 0.53
F3 P13726 3/20 0.53
PPARG P37231 2/20 0.53
PPARD Q03181 2/20 0.53
PPARA Q07869 2/20 0.53
FABP3 P05413 2/20 0.53
DUSP3 P51452 1/20 0.53
PTPN7 P35236 1/20 0.53
FFAR1 O14842 1/20 0.53
LMNA P02545 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP19A1 P11511 1/20 0.53
FABP4 P15090 1/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
PTGS1 P23219 1/20 0.53

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
SCHEMBL19895419 1.00 TSHR (0.62) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL19895416 1.00 TSHR (0.62) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL19895420 1.00 TSHR (0.62) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL19895425 1.00 TSHR (0.62) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL2634273 0.98 TSHR (0.58) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL19895429 0.98 TSHR (0.58) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL1296303 0.93 TSHR (0.73) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL20543183 0.93 TSHR (0.73) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL11073391 0.93 TSHR (0.73) TSHRTRPV1ALDH1A1KDM4EF7
SCHEMBL9155807 0.93 TSHR (0.73) TSHRTRPV1ALDH1A1KDM4EF7

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-2008152226-A2 HOMOGENEOUS AND STABLE COMPOSITION RICH IN OLEAGINOUS SUBSTANCES BASED ON A MILK PRODUCT, METHOD FOR THE PREPARATION THEREOF AND USES THEREOF IN-CYCLO (FR) 2008-12-18 WO disclosed