SCHEMBL20375659

SCHEMBL20375659

CNC(C(=O)N[C@H](CCCNC(N)=O)C(C)=O)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 2/20 0.36
▸ KISS1R Q969F8 1/20 0.35
▸ C3AR1 Q16581 1/20 0.34
▸ FURIN P09958 5/20 0.34
▸ SIRT6 Q8N6T7 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPY4R P50391 3/20 0.32
▸ NPY1R P25929 2/20 0.32
▸ NPY2R P49146 2/20 0.32
▸ NPY5R Q15761 2/20 0.32
▸ REN P00797 1/20 0.32
▸ NOD1 Q9Y239 1/20 0.32

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
SCHEMBL15499691 1.00 SIRT5 (0.36) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL21103418 1.00 SIRT5 (0.36) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL18661755 1.00 SIRT5 (0.36) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL20375788 1.00 SIRT5 (0.36) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL16091799 1.00 SIRT5 (0.36) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL23393940 0.93 SIRT5 (0.39) SIRT5C3AR1FURINLMNAPOLB
SCHEMBL25092038 0.89 SIRT5 (0.44) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL17993275 0.89 SIRT5 (0.44) SIRT5KISS1RC3AR1FURINSIRT6
SCHEMBL24490420 0.89 C3AR1 (0.34) SIRT5C3AR1FURINSIRT6SIRT1
SCHEMBL20795891 0.89 FURIN (0.36) SIRT5C3AR1FURINSIRT6SIRT1

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-2018127699-A1 COMPOUNDS FOR TREATING CANCER Bicyclerd Limited (GB) 2018-07-12 — — WO disclosed
Send feedback