SCHEMBL14877938

SCHEMBL14877938

CCCCCCC(=O)NCCCCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 5/20 0.66
SIRT2 Q8IXJ6 5/20 0.58
SIRT1 Q96EB6 2/20 0.58
KMT2A Q03164 1/20 0.58
TNF P01375 2/20 0.51
MDM2 Q00987 4/20 0.50
SIRT3 Q9NTG7 1/20 0.50

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
SCHEMBL29399069 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL21326215 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL30436437 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL17747061 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL21326214 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL21908195 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL17747033 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL17747043 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL17747040 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF
SCHEMBL17747034 1.00 TLR2 (0.66) TLR2SIRT2SIRT1KMT2ATNF

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-8426618-B2 Luminescence quenching compounds ANASPEC INCORPORATED (US) 2013-04-23 US disclosed