SCHEMBL29296435

SCHEMBL29296435

CNCCCCC(NC)C(=O)NC(C(=O)NC(CCCNC(N)=O)C(C)=O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 3/20 0.41
▸ KISS1R Q969F8 1/20 0.38
▸ FURIN P09958 11/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ SIRT6 Q8N6T7 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ PCSK6 P29122 1/20 0.34
▸ PRSS1 P07477 2/20 0.34
▸ NPY4R P50391 3/20 0.32
▸ NPY1R P25929 2/20 0.32
▸ NPY2R P49146 2/20 0.32
▸ NPY5R Q15761 2/20 0.32
▸ CTSL P07711 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
SCHEMBL22788836 0.91 FURIN (0.36) SIRT5KISS1RFURINSIRT2PCSK6
SCHEMBL21153627 0.89 SIRT5 (0.37) SIRT5FURINSIRT2PCSK6PRSS1
SCHEMBL22788736 0.89 FURIN (0.37) SIRT5FURINSIRT2SIRT6SIRT1
SCHEMBL26894580 0.88 SIRT5 (0.37) SIRT5FURINSIRT2PCSK6PRSS1
SCHEMBL27067717 0.87 SIRT5 (0.45) SIRT5FURINSIRT2
SCHEMBL21153628 0.87 SIRT5 (0.45) SIRT5FURINSIRT2
SCHEMBL16091799 0.86 SIRT5 (0.36) SIRT5KISS1RFURINSIRT6SIRT1
SCHEMBL18661755 0.86 SIRT5 (0.36) SIRT5KISS1RFURINSIRT6SIRT1
SCHEMBL21103418 0.86 SIRT5 (0.36) SIRT5KISS1RFURINSIRT6SIRT1
SCHEMBL15499691 0.86 SIRT5 (0.36) SIRT5KISS1RFURINSIRT6SIRT1

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
EP-3883926-B1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDE DERIVATIVES AND PROTEIN CONJUGATES THEREOF FOR USE AS LXR AGONISTS REGENERON PHARMA (US) 2024-07-10 — — EP disclosed
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