SCHEMBL19646499

SCHEMBL19646499

O=C(CCOCCCOCCC(=O)NCCCCCCCC(=O)ON1C(=O)CCC1O)NCCCCCCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL20848172 0.93 SMN1; SMN2 (0.40) HPGDHTTSMN1; SMN2TSHRHSD17B10
SCHEMBL18914838 0.91 HPGD (0.34) HPGDHTTSMN1; SMN2TSHRHSD17B10
SCHEMBL19658379 0.89 HPGD (0.35) HPGDHTTSMN1; SMN2
SCHEMBL15773182 0.89 SMN1; SMN2 (0.44) HPGDHTTSMN1; SMN2TSHRHSD17B10
SCHEMBL15773227 0.89 HPGD (0.38) HPGDHTTSMN1; SMN2
SCHEMBL17168463 0.88 SMN1; SMN2 (0.46) HPGDHTTSMN1; SMN2TSHR
SCHEMBL17168610 0.86 SMN1; SMN2 (0.44) HPGDHTTSMN1; SMN2
SCHEMBL17244738 0.86
SCHEMBL17168856 0.86 SMN1; SMN2 (0.45) HPGDHTTSMN1; SMN2TSHRHSD17B10
SCHEMBL17167517 0.85 SMN1; SMN2 (0.41) HPGDHTTSMN1; SMN2HSD17B10

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
US-9828341-B2 Dendritic core compounds VICTORIA LINK LIMITED (NZ) 2017-11-28 US disclosed