SCHEMBL743324

SCHEMBL743324

CN(C)C(=O)C1CCC(NC(=O)c2cc3ccc(Cl)cc3cn2)(C(=O)OC(C)(C)C)C(N)C1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.46
ATF4 P18848 1/20 0.39
ANO1 Q5XXA6 1/20 0.39
ABL1 P00519 6/20 0.34
CNR2 P34972 1/20 0.31

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
SCHEMBL740563 0.88 F10 (0.43) F10ATF4ANO1
SCHEMBL740808 0.81 F10 (0.44) F10
SCHEMBL12095609 0.77 F10 (0.39) F10ATF4ANO1ABL1
SCHEMBL4083820 0.76 F10 (0.65) F10
SCHEMBL12035519 0.73 F10 (0.65) F10
SCHEMBL741538 0.73 SMYD3 (0.46)
SCHEMBL743062 0.72 F10 (0.32) F10
SCHEMBL739377 0.71 F10 (0.44) F10
SCHEMBL739706 0.70 KMT2A (0.50)
SCHEMBL12056214 0.69 F10 (0.56) 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 2 patents. 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
US-7935824-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-05-03 US disclosed