SCHEMBL10143586

SCHEMBL10143586

CCCCn1c(=O)cc(C)c2ccc(NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](COCc3ccccc3)NC(=O)OCC3c4ccccc4-c4ccccc43)cc21

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.42
▸ SIRT2 Q8IXJ6 14/20 0.41
▸ SIRT1 Q96EB6 12/20 0.41
▸ SIRT3 Q9NTG7 4/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL10144109 0.95 MDM2 (0.42) MDM2SIRT2SIRT1SIRT3MEN1
SCHEMBL10143408 0.92 MDM2 (0.41) MDM2SIRT2SIRT1SIRT3
SCHEMBL10143415 0.92 CTSS (0.42) MDM2SIRT2SIRT1SIRT3
SCHEMBL10144408 0.90 TLR2 (0.47) SIRT2SIRT1SIRT3
SCHEMBL10144158 0.88 MDM2 (0.41) MDM2SIRT2SIRT1MEN1KMT2A
SCHEMBL10144410 0.88 MDM2 (0.41) MDM2SIRT2SIRT1SIRT3
SCHEMBL10143498 0.86 MDM2 (0.41) MDM2SIRT2SIRT1SIRT3MEN1
SCHEMBL10144131 0.85 MDM2 (0.41) MDM2SIRT2SIRT1
SCHEMBL10144445 0.85 TLR2 (0.46) MDM2SIRT2SIRT1SIRT3
SCHEMBL10144113 0.82 MDM2 (0.41) MDM2SIRT2SIRT1

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 — — WO disclosed
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