SCHEMBL743656

SCHEMBL743656

CC(C)(C)OC(=O)N1Cc2nc(C(=O)C3(N)CCCCC3NC(=O)c3cc4cc(Cl)ccc4[nH]3)sc2C1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.56
F2 P00734 4/20 0.51

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
SCHEMBL743739 0.85 F10 (0.60) F10F2
Hydrochloric Acid SCHEMBL743787 0.85 F10 (0.52) F10F2
SCHEMBL4089163 0.85 F10 (0.72) F10F2
SCHEMBL4089165 0.85 F10 (0.72) F10F2
SCHEMBL739574 0.85 F10 (0.45) F10F2
SCHEMBL741264 0.84 F10 (0.53) F10F2
SCHEMBL742968 0.84 F10 (0.54) F10F2
Hydrochloric Acid SCHEMBL743409 0.82 F10 (0.57) F10F2
Hydrochloric Acid SCHEMBL742703 0.82 F10 (0.57) F10F2
Hydrochloric Acid SCHEMBL742089 0.82 F10 (0.61) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2431370-B1 Monoacylated 1,2-diaminocycloalkanes DAIICHI SANKYO CO LTD (JP) 2013-06-19 EP disclosed
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