SCHEMBL23449071

SCHEMBL23449071

CON(C)C(=O)c1ccc2nc(-c3ccc(OCCCNC(=O)OC(C)(C)C)cc3)[nH]c2c1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CHEK2 O96017 12/20 0.54
▸ HDAC6 Q9UBN7 2/20 0.50
▸ PLG P00747 4/20 0.48
▸ PLAU P00749 4/20 0.48
▸ BRD4 O60885 1/20 0.44

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
SCHEMBL23424051 0.82 CHEK2 (0.48) CHEK2HDAC6PLGPLAUBRD4
SCHEMBL23153401 0.81 CHEK2 (0.63) CHEK2HDAC6
SCHEMBL21017933 0.80 BRD4 (0.47) CHEK2HDAC6PLGPLAUBRD4
SCHEMBL1233400 0.80 CHEK2 (0.58) CHEK2HDAC6PLGPLAU
SCHEMBL23424094 0.80 BRD4 (0.47) CHEK2HDAC6BRD4
SCHEMBL20982733 0.80 CHEK2 (0.58) CHEK2HDAC6
SCHEMBL16586762 0.79 CHEK2 (0.58) CHEK2HDAC6PLGPLAU
SCHEMBL16586792 0.79 CHEK2 (0.57) CHEK2HDAC6PLGPLAU
SCHEMBL21017942 0.78 HDAC6 (0.58) CHEK2HDAC6
SCHEMBL12888578 0.78 CHEK2 (0.55) CHEK2HDAC6PLGPLAU

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-2021105887-A1 SEPARATION AND ISOLATION OF NUCLEIC ACIDS USING AFFINITY LIGANDS BOUND TO A SOLID SURFACE EMP BIOTECH GMBH (DE) 2021-06-03 — — WO disclosed
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