SCHEMBL24787485

SCHEMBL24787485

CCCCCCCCC(CN(CCC(=O)NCC[N+](C)(C)CCCS(=O)(=O)O)CCN(CCN(CC(CCCCCCCC)OC(C)=O)CC(CCCCCCCC)OC(C)=O)CCN(CC(CCCCCCCC)OC(C)=O)CC(CCCCCCCC)OC(C)=O)OC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.33
TLR2 O60603 1/20 0.32
CASP2 P42575 1/20 0.32
FAAH O00519 2/20 0.31
EPHX2 P34913 1/20 0.31
NAAA Q02083 1/20 0.31
GLS2 Q9UI32 2/20 0.30
TRPV1 Q8NER1 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 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
SCHEMBL24787484 0.92 TLR2 (0.40) DNM1TLR2ALDH1A1MAPT
SCHEMBL25681904 0.92 TLR2 (0.40) DNM1TLR2ALDH1A1MAPT
SCHEMBL19681644 0.92 MEN1 (0.32) DNM1EPHX2TRPV1MAPT
SCHEMBL24787486 0.91 DNM1 (0.31) DNM1TLR2CASP2
SCHEMBL25681831 0.86 FAAH (0.36) DNM1CASP2FAAHEPHX2NAAA
SCHEMBL25682074 0.85 DNM1 (0.35) DNM1CASP2FAAHEPHX2NAAA
SCHEMBL25681951 0.83 DNM1 (0.42) DNM1CASP2FAAHEPHX2NAAA
SCHEMBL19681645 0.78 FAAH (0.35) DNM1CASP2FAAHEPHX2NAAA
SCHEMBL21965331 0.78 DNM1 (0.34) DNM1CASP2FAAHEPHX2NAAA
SCHEMBL19681579 0.78 GLS2 (0.39) TLR2FAAHEPHX2GLS2

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-2022261185-A1 POLYNUCLEOTIDE COMPOSITIONS, RELATED FORMULATIONS, AND METHODS OF USE THEREOF RECODE THERAPEUTICS, INC. (US) 2022-12-15 WO disclosed