SCHEMBL4290451

SCHEMBL4290451

CC1(C)CC(N([AsH2])C(=O)C(N)=O)CC(C)(C)N1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.35
GAA P10253 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL4459766 0.81 ALOX15 (0.37) ALOX15GAAPOLB
SCHEMBL817041 0.80 ALOX15 (0.36) ALOX15GAAPOLB
SCHEMBL9350995 0.72 ALOX15 (0.41) ALOX15GAAPOLB
SCHEMBL8335947 0.72 ALOX15 (0.38) ALOX15GAAPOLB
SCHEMBL28493632 0.68 ALOX15 (0.38) ALOX15GAAPOLB
SCHEMBL11523930 0.68 ALOX15 (0.35) ALOX15GAAPOLB
SCHEMBL11983506 0.67 ALOX15 (0.40) ALOX15GAAPOLB
SCHEMBL11099845 0.67 ALOX15 (0.50) ALOX15GAAPOLB
SCHEMBL24794769 0.67 ALOX15 (0.40) ALOX15
SCHEMBL8340480 0.67 ALOX15 (0.35) ALOX15GAAPOLB

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-2041216-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSMIP Assets B.V. (NL) 2009-04-01 EP disclosed
WO-2008006491-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2008-01-17 WO disclosed