SCHEMBL19613155

SCHEMBL19613155

CCCCCCCCC/C=C/C=C/C=C/C=C/C=C/C=C/C(=O)OC(COCCC)COCCC

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.46
CNR2 P34972 2/20 0.46
KDM4E B2RXH2 1/20 0.45
FASN P49327 1/20 0.44
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
PRKCE Q02156 1/20 0.40
PRKCQ Q04759 1/20 0.40
PRKCD Q05655 1/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40

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
SCHEMBL19613156 1.00 CNR1 (0.46) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL317505 1.00 CNR1 (0.46) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL19612862 1.00 CNR1 (0.46) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL19612860 1.00 CNR1 (0.46) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL317504 1.00 CNR1 (0.46) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL19613188 0.90 CNR1 (0.47) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL19612868 0.90 CNR1 (0.47) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL19612869 0.90 CNR1 (0.47) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL317399 0.90 CNR1 (0.47) CNR1CNR2KDM4EFASNALDH1A1
SCHEMBL317400 0.90 CNR1 (0.47) CNR1CNR2KDM4EFASNALDH1A1

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
US-20180280337-A1 NUTRITIONAL COMPOSITIONS COMPRISING SN-1(3) MONOACYLGLYCEROLS FOR USE IN THE TREATMENT OF GROWTH DELAY IN INFANTS OR CHILDREN Société des Produits Nestlé S.A. (CH) 2018-10-04 US disclosed
US-20170332691-A1 NUTRITIONAL COMPOSITIONS COMPRISING SN-1 (3) MONOACYLGLYCEROLS FOR USE IN THE TREATMENT OF MALABSORPTION OR MALDIGESTION IN INFANTS OR YOUNG CHILDREN Société des Produits Nestlé S.A. (CH) 2017-11-23 US disclosed