SCHEMBL18084214

SCHEMBL18084214

COC(=O)NC(CCCCNC(=O)O)C(=O)NCCC(=O)NCCNC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.42
▸ SIRT2 Q8IXJ6 8/20 0.40
▸ SIRT1 Q96EB6 7/20 0.37
▸ GLP1R P43220 8/20 0.35
▸ SIRT3 Q9NTG7 3/20 0.35
▸ TPSAB1 Q15661 2/20 0.35

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
SCHEMBL14755924 0.94 AKT1 (0.41) AKT1SIRT2SIRT1GLP1RSIRT3
SCHEMBL17488484 0.92 AKT1 (0.40) AKT1SIRT2SIRT1GLP1RSIRT3
SCHEMBL11964062 0.92 AKT1 (0.42) AKT1SIRT2SIRT1GLP1RSIRT3
SCHEMBL11964063 0.85 SIRT2 (0.38) AKT1SIRT2SIRT1GLP1RSIRT3
SCHEMBL18480125 0.85 AKT1 (0.39) AKT1SIRT2SIRT1GLP1RSIRT3
SCHEMBL277647 0.85 SIRT2 (0.45) AKT1SIRT2SIRT1SIRT3TPSAB1
SCHEMBL12389311 0.83 SIRT2 (0.42) AKT1SIRT2SIRT1SIRT3TPSAB1
SCHEMBL14542727 0.83 AKT1 (0.36) AKT1SIRT2SIRT1
SCHEMBL15146939 0.83 SIRT2 (0.39) SIRT2SIRT1GLP1RSIRT3TPSAB1
SCHEMBL12692598 0.82 HDAC4 (0.41) AKT1SIRT2SIRT1GLP1RSIRT3

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-9433684-B2 Conjugates of small-interfering nucleic acids NEKTAR THERAPEUTICS (US) 2016-09-06 — — US disclosed
Send feedback