SCHEMBL10143543

SCHEMBL10143543

Cc1cc(=O)[nH]c2cc(NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](Cc3cccc4ccccc34)NC(=O)OCC3c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 1/20 0.40
▸ CTSK P43235 1/20 0.40
▸ MDM2 Q00987 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CCKBR P32239 1/20 0.40
▸ TPSAB1 Q15661 1/20 0.40
▸ SIRT5 Q9NXA8 1/20 0.38
▸ TGM2 P21980 1/20 0.37

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
SCHEMBL10144432 0.91 CA1 (0.45) MDM2CA1CA2TPSAB1SIRT5
SCHEMBL10144428 0.90 TLR2 (0.42) MDM2TPSAB1
SCHEMBL10143500 0.89 SIRT5 (0.42) MDM2CA1CA2TPSAB1SIRT5
SCHEMBL10144419 0.89 MDM2 (0.41) MDM2CA1CA2CCKBRTPSAB1
SCHEMBL10143496 0.88 CA1 (0.42) MDM2CA1CA2TPSAB1SIRT5
SCHEMBL10144194 0.86 MDM2 (0.39) MDM2CA1CA2TPSAB1SIRT5
SCHEMBL10143498 0.86 MDM2 (0.41) CTSSMDM2CA1CA2SIRT5
SCHEMBL10144152 0.85 MDM2 (0.38) MDM2CA1CA2TPSAB1SIRT5
SCHEMBL10143509 0.85 CACNA1B (0.39) MDM2CA1CA2TPSAB1SIRT5
SCHEMBL10144210 0.84 MDM2 (0.40) CTSSCTSKMDM2CA1CA2

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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