SCHEMBL366235

SCHEMBL366235

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

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 5/20 0.40
▸ TPSAB1 Q15661 1/20 0.38
▸ TLR2 O60603 2/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ SLC17A5 Q9NRA2 1/20 0.37
▸ MDM4 O15151 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CASP3 P42574 2/20 0.35

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
SCHEMBL366234 0.84 MDM2 (0.39) MDM2TPSAB1TLR2EPHX2SLC17A5
SCHEMBL10144432 0.84 CA1 (0.45) MDM2TPSAB1TLR2
SCHEMBL10143499 0.84 TLR2 (0.45) MDM2TPSAB1TLR2EPHX2
SCHEMBL10143502 0.82 TLR2 (0.45) TPSAB1TLR2
SCHEMBL10143497 0.82 TLR2 (0.42) MDM2TPSAB1TLR2SLC17A5
SCHEMBL10143496 0.81 CA1 (0.42) MDM2TPSAB1TLR2
SCHEMBL10143401 0.81 TLR2 (0.46) TLR2
SCHEMBL10144446 0.80 TLR2 (0.43) MDM2TPSAB1TLR2EPHX2
SCHEMBL10143500 0.80 SIRT5 (0.42) MDM2TPSAB1TLR2
SCHEMBL10144324 0.80 TLR2 (0.44) TPSAB1TLR2

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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