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SCHEMBL10144419

SCHEMBL10144419

Cc1cc(=O)[nH]c2cc(NC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)C(Cc3ccncc3)NC(=O)OCC3c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.41
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ PSMB8 P28062 1/20 0.38
▸ PSMB9 P28065 1/20 0.38
▸ PSMB5 P28074 1/20 0.38
▸ CCKBR P32239 1/20 0.38
▸ TPSAB1 Q15661 1/20 0.38
▸ PAX8 Q06710 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38

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 0.92 CA1 (0.45) MDM2CA1CA2TPSAB1TDP1
SCHEMBL10143500 0.90 SIRT5 (0.42) MDM2CA1CA2TPSAB1
SCHEMBL10143496 0.89 CA1 (0.42) MDM2CA1CA2TPSAB1TDP1
SCHEMBL10143543 0.89 CTSS (0.40) MDM2CA1CA2CCKBRTPSAB1
SCHEMBL10143498 0.88 MDM2 (0.41) MDM2CA1CA2TDP1
SCHEMBL10144194 0.87 MDM2 (0.39) MDM2CA1CA2TPSAB1
SCHEMBL10144152 0.87 MDM2 (0.38) MDM2CA1CA2TPSAB1TDP1
SCHEMBL10144430 0.85 MDM2 (0.41) MDM2CA1CA2TPSAB1TDP1
SCHEMBL10143509 0.85 CACNA1B (0.39) MDM2CA1CA2TPSAB1
SCHEMBL10144130 0.85 CA1 (0.39) MDM2CA1CA2TPSAB1TDP1

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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