SCHEMBL742448

SCHEMBL742448

CN1CCc2nc(C(=O)NC3CC(COC(=O)N(C)C)CC3(N)C(=O)c3cc4cc(Cl)ccc4[nH]3)sc2C1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.60
F2 P00734 5/20 0.58
PLAT P00750 1/20 0.58

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
SCHEMBL741905 0.90 F10 (0.69) F10F2
SCHEMBL742931 0.89 F10 (0.58) F10F2
Hydrochloric Acid SCHEMBL743646 0.89 F10 (0.68) F10F2
Hydrochloric Acid SCHEMBL743092 0.86 F10 (0.69) F10F2PLAT
SCHEMBL739676 0.86 F10 (0.69) F10F2
Hydrochloric Acid SCHEMBL743602 0.86 F10 (0.71) F10F2
SCHEMBL10476620 0.86 F10 (0.78) F10F2PLAT
SCHEMBL4098461 0.86 F10 (0.78) F10F2PLAT
SCHEMBL764532 0.86 F10 (0.78) F10F2PLAT
SCHEMBL741559 0.85 F10 (0.68) 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 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