SCHEMBL11888199

SCHEMBL11888199

CNC(=O)[C@H]1CC[C@@H](NC(=O)c2nc3c(s2)CN(C)CC3)[C@@H](NC(=O)C2Cc3cc(C)ccc3N2)C1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 20/20 0.54
▸ F2 P00734 1/20 0.50
▸ PLAT P00750 1/20 0.50

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
SCHEMBL10279471 0.92 F10 (0.53) F10F2PLAT
SCHEMBL765471 0.90 F10 (0.52) F10
SCHEMBL10280078 0.90 F10 (0.53) F10
SCHEMBL765153 0.90 F10 (0.56) F10F2
SCHEMBL12101145 0.89 F10 (0.48) F10F2
SCHEMBL12507960 0.85 F10 (0.60) F10F2PLAT
SCHEMBL12507971 0.84 F10 (0.71) F10F2PLAT
SCHEMBL11888310 0.82 F10 (0.62) F10F2PLAT
SCHEMBL12507962 0.82 F10 (0.45) F10F2
SCHEMBL11888244 0.82 F10 (0.65) F10F2

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-1270557-B1 ETHYLENEDIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-07-25 — — EP disclosed
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