SCHEMBL743024

SCHEMBL743024

NC1(C(=O)c2cc3cc(Cl)ccc3[nH]2)CCCCC1NC(=O)c1nc2c(s1)COCC2

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.51
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
SCHEMBL741610 0.87 F10 (0.52) F10F2
Hydrochloric Acid SCHEMBL740246 0.87 F10 (0.51) F10F2
Hydrochloric Acid SCHEMBL742946 0.85 F10 (0.49) F10F2
Hydrochloric Acid SCHEMBL741606 0.85 F10 (0.55) F10F2
SCHEMBL740569 0.85 F10 (0.72) F10F2
Hydrochloric Acid SCHEMBL742100 0.85 F10 (0.71) F10F2
SCHEMBL743139 0.85 F10 (0.72) F10F2
SCHEMBL1864021 0.84 F10 (0.60) F10F2
Hydrochloric Acid SCHEMBL742089 0.84 F10 (0.61) F10F2
Hydrochloric Acid SCHEMBL742703 0.84 F10 (0.57) 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