SCHEMBL6558019

SCHEMBL6558019

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

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL6558021 0.78 GAA (0.45) ALDH1A1CYP3A4
SCHEMBL14540759 0.76
SCHEMBL441905 0.75 ALDH1A1 (0.43) ALDH1A1CYP3A4
SCHEMBL19994523 0.71
SCHEMBL28504122 0.69 ALDH1A1 (0.36) ALDH1A1CYP3A4
SCHEMBL7636853 0.64 GAA (0.31)
SCHEMBL16245364 0.63 GAA (0.30)
SCHEMBL668940 0.63 GAA (0.56)
SCHEMBL377189 0.63 GAA (0.30)
SCHEMBL1932447 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7053553-A None JP disclosed
EP-1058698-B1 PREPARATION FOR PREVENTION AND HEALING OF INFLAMMATION AFFECTIONS USTAV MAKROMOLEKULARNI CHEMIE (CZ) 2004-07-28 EP disclosed
US-6610284-B1 Derivatives of sterically hindered amines selected from the group consisting of: soluble polymers or copolymers prepared by radical polymerization in the presence of 0.01 to 10% by weight, of initiators prepared:in a polymerization mixture INSTITUTE OF MACROMOLECULAR CHEMISTRY (CZ) 2003-08-26 US disclosed
JP-H0753553-A NEW PODOPHYLLOTOXIN DERIVATIVE ITO HITOSHI 1995-02-28 JP disclosed