SCHEMBL15420335

SCHEMBL15420335

CCC/C=C/C#CCCCCCCCCC

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 6/20 0.63
PPARG P37231 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
PTPN7 P35236 4/20 0.38

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
SCHEMBL15420337 1.00 HMGCR (0.63) HMGCRPPARGTRPV1PTPN7
SCHEMBL17027691 1.00 HMGCR (0.63) HMGCRPPARGTRPV1PTPN7
SCHEMBL17027690 1.00 HMGCR (0.63) HMGCRPPARGTRPV1PTPN7
SCHEMBL16161087 0.86 HMGCR (0.50) HMGCRPPARGTRPV1
SCHEMBL16161118 0.86 HMGCR (0.50) HMGCRPPARGTRPV1
SCHEMBL16161077 0.86 HMGCR (0.50) HMGCRPPARGTRPV1
SCHEMBL16161183 0.86 HMGCR (0.50) HMGCRPPARGTRPV1
SCHEMBL16161076 0.86 HMGCR (0.50) HMGCRPPARGTRPV1
SCHEMBL16161184 0.86 HMGCR (0.50) HMGCRPPARGTRPV1
SCHEMBL16161167 0.86 HMGCR (0.50) HMGCRPPARGTRPV1

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-20140023721-A1 METHOD OF EXTRACTING ACTIVE MOLECULES FROM NATURAL RESINS AND USE THEREOF RODE PHARMA S.R.L. (IT) 2014-01-23 US disclosed