SCHEMBL16898595

SCHEMBL16898595

[N-]=[N+]=NCCOCCOCCOCCOCCOCN1CCN(C(=O)O)CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 3/20 0.32
▸ MGMT P16455 1/20 0.32

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
SCHEMBL16898784 0.88 MGMT (0.36) MGMT
SCHEMBL16898524 0.88 MGMT (0.36) MGMT
SCHEMBL16898349 0.88 MGMT (0.36) MGMT
SCHEMBL16898643 0.88 MGMT (0.36) MGMT
SCHEMBL16898614 0.87 MGMT (0.35) MGMT
SCHEMBL16906830 0.81 USP2 (0.38) CRBN
SCHEMBL20362162 0.77 MGMT (0.30) MGMT
SCHEMBL16898439 0.75 MGMT (0.34) MGMT
SCHEMBL21070724 0.73 CHRNB2 (0.31) —
SCHEMBL20362229 0.72 LIPG (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015106292-A1 BCR-ABL TYROSINE-KINASE LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2015-07-16 — — WO disclosed
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