SCHEMBL10280078

SCHEMBL10280078

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

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 20/20 0.53

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
SCHEMBL11888199 0.90 F10 (0.54) F10
SCHEMBL765471 0.89 F10 (0.52) F10
SCHEMBL10279471 0.88 F10 (0.53) F10
SCHEMBL765153 0.86 F10 (0.56) F10
SCHEMBL12101145 0.85 F10 (0.48) F10
SCHEMBL11888217 0.84 F10 (0.73) F10
SCHEMBL13387641 0.81 F10 (0.41) F10
SCHEMBL12507960 0.81 F10 (0.60) F10
SCHEMBL11888310 0.81 F10 (0.62) F10
SCHEMBL12507971 0.80 F10 (0.71) F10

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-2431370-A1 Monoacylated 1,2-diaminocycloalkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2012-03-21 — — EP disclosed
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