SCHEMBL7517034

SCHEMBL7517034

NCC(N)CNC(CN)CN

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.42

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
SCHEMBL19934633 0.74 OPRK1 (0.38) OPRK1
SCHEMBL19934675 0.74 OPRK1 (0.38) OPRK1
SCHEMBL1274779 0.74 OPRK1 (0.38) OPRK1
SCHEMBL7935141 0.74 OPRK1 (0.42) OPRK1
SCHEMBL21153274 0.74 OPRK1 (0.38) OPRK1
SCHEMBL662214 0.74 OPRK1 (0.38) OPRK1
SCHEMBL19934670 0.74 OPRK1 (0.38) OPRK1
SCHEMBL21134687 0.74 OPRK1 (0.38) OPRK1
SCHEMBL21111319 0.74 OPRK1 (0.38) OPRK1
Hydrochloric Acid SCHEMBL21084938 0.72 OPRK1 (0.37) OPRK1

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
US-20020066542-A1 Transition metal complexes with polydentate ligands for enhancing the bleaching and delignifying effect of peroxo compounds DEGUSSA AG (DE) 2002-06-06 US disclosed
EP-1199402-A2 Process for delignifying and/or bleaching fibrous material Degussa AG (DE) 2002-04-24 EP disclosed