SCHEMBL23031850

SCHEMBL23031850

N=N/C(=C\N)COCc1ccc(-c2nncnn2)cc1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 1/20 0.35

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
SCHEMBL23032000 0.80 KDM4E (0.30) KDM4ETP53MAPT
SCHEMBL23031868 0.76 IDO1 (0.42) KDM4E
SCHEMBL23031853 0.73 RAB9A (0.40) MAPT
SCHEMBL23031883 0.69 KDM4E (0.31) KDM4ETP53MAPT
SCHEMBL23015077 0.67 TP53 (0.43) KDM4ETP53MAPT
SCHEMBL17070862 0.66 TP53 (0.58) KDM4ETP53MAPT
SCHEMBL26014568 0.64 TP53 (0.46) KDM4ETP53MAPT
SCHEMBL9887574 0.63 ADRB2 (0.55) KDM4ETP53MAPT
SCHEMBL1299054 0.63 TP53 (0.48) KDM4ETP53MAPT
SCHEMBL23015083 0.63 TP53 (0.39) KDM4ETP53MAPT

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-2021034924-A1 TRANS-CYCLOOCTENE LABELED ANTISENSE OLIGONUCLEOTIDES, RADIO LABELED TETRAZINE AND METHODS BIOGEN MA INC. (US) 2021-02-25 — — WO disclosed
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