SCHEMBL22296807

SCHEMBL22296807

CCC(CC)CCC(C)(C)OCCC(C)(C)NC(C)=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.31
PKM P14618 1/20 0.31
ACACB O00763 1/20 0.31
HTT P42858 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL21415279 0.87 THRB (0.30) THRBPKMACACB
SCHEMBL21251591 0.85 ATM (0.33) THRBPKMACACBHTTALDH1A1
SCHEMBL21415343 0.84 PKM (0.31) PKM
SCHEMBL16592004 0.82 ALDH1A1 (0.42) THRBPKMACACBHTTALDH1A1
SCHEMBL10035850 0.80 PKM (0.36) THRBPKMACACBHTTALDH1A1
SCHEMBL21698156 0.80 MAPT (0.34) THRBPKMACACBHTTALDH1A1
SCHEMBL26696658 0.80 ALDH1A1 (0.40) THRBPKMACACBHTTALDH1A1
SCHEMBL24821941 0.78
SCHEMBL22104690 0.76 THRB (0.32) THRBPKMACACBHTTALDH1A1
SCHEMBL13460305 0.75 ALDH1A1 (0.32) ALDH1A1

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
EP-3845547-A1 GALNAC3 CONJUGATED MODIFIED OLIGONUCLEOTIDE FOR MODULATING ANGIOPOIETIN-LIKE 3 EXPRESSION Ionis Pharmaceuticals, Inc. (US) 2021-07-07 EP disclosed
EP-3690049-A1 COMPOSITIONS AND METHODS FOR MODULATING APOLIPOPROTEIN C-III EXPRESSION Ionis Pharmaceuticals, Inc. (US) 2020-08-05 EP disclosed