SCHEMBL7530875

SCHEMBL7530875

CN1CCN(CCN)CCN(CCN)CC1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.77
ACE2 Q9BYF1 1/20 0.44
SIGMAR1 Q99720 4/20 0.42
NCF1 P14598 2/20 0.40
PAOX Q6QHF9 1/20 0.40
LMNA P02545 1/20 0.40
CA2 P00918 1/20 0.39
CHKA P35790 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MC4R P32245 1/20 0.38
KEAP1 Q14145 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL42017 1.00 ALOX15 (0.77) ALOX15ACE2SIGMAR1NCF1PAOX
SCHEMBL10685407 1.00 ALOX15 (0.77) ALOX15ACE2SIGMAR1NCF1PAOX
Hydrochloric Acid SCHEMBL6898782 0.97 ALOX15 (0.72) ALOX15ACE2SIGMAR1NCF1PAOX
Hydrochloric Acid SCHEMBL3668489 0.97 ALOX15 (0.72) ALOX15ACE2SIGMAR1NCF1PAOX
Hydrochloric Acid SCHEMBL1934087 0.97 ALOX15 (0.72) ALOX15ACE2SIGMAR1NCF1PAOX
SCHEMBL2916359 0.90 ALOX15 (0.62) ALOX15SIGMAR1NCF1CA2CHKA
Bicarbonate SCHEMBL16668953 0.88 ALOX15 (0.59) ALOX15ACE2SIGMAR1PAOXLMNA
SCHEMBL3975418 0.87 ALOX15 (1.00) ALOX15ACE2SIGMAR1PRMT6ALDH1A1
SCHEMBL179843 0.87 ALOX15 (1.00) ALOX15ACE2SIGMAR1PRMT6ALDH1A1
SCHEMBL242967 0.87

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100075888-A1 BLEACH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2010-03-25 US disclosed
US-20080125344-A1 Bleach compositions BUSCH DARYLE HADLEY 2008-05-29 US disclosed
EP-1338337-B1 Catalysts and methods for catalytic oxidation PROCTER & GAMBLE (US) 2007-07-18 EP disclosed
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