SCHEMBL18012701

SCHEMBL18012701

CCCCC1(CCCC)c2cc(Br)ccc2-c2ccc(/C(C/C(C)=N/OC(C)=O)=N\OC(C)=O)cc21

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OGG1 O15527 1/20 0.34
▸ PKM P14618 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HDAC3 O15379 3/20 0.31
▸ HDAC1 Q13547 3/20 0.31
▸ HDAC2 Q92769 3/20 0.31
▸ HDAC10 Q969S8 1/20 0.31
▸ HDAC11 Q96DB2 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ NCOR2 Q9Y618 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 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
SCHEMBL18012790 0.89 MEN1 (0.32) PKMMEN1KMT2AMAPT
SCHEMBL18012697 0.85 ALK (0.32) PKMALDH1A1MAPT
SCHEMBL18012793 0.85 PDK2 (0.35) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL18012700 0.85 HDAC3 (0.35) PKMMEN1ALDH1A1KMT2AHDAC3
SCHEMBL18012818 0.84 PKM (0.37) PKMMEN1KMT2AMAPT
SCHEMBL18012820 0.81 CA2 (0.37) PKMALDH1A1MAPT
SCHEMBL18012812 0.80 — —
SCHEMBL18012817 0.79 PDK2 (0.36) PKMMEN1KMT2AMAPT
SCHEMBL18994268 0.78 PKM (0.31) PKM
SCHEMBL18012737 0.78 PDK2 (0.38) PKM

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-2016126070-A1 NOVEL OXIMESTER DERIVATIVE COMPOUND, AND PHOTOPOLYMERIZATION INITIATOR AND PHOTORESIST COMPOSITION CONTAINING SAME 한국화학연구원 2016-08-11 — — WO disclosed
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