SCHEMBL5574060

SCHEMBL5574060

O=C1C=C(Cl)C(=O)C(I)=C1Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ ALOX12 P18054 2/20 0.33
▸ RECQL P46063 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ CES2 O00748 2/20 0.32
▸ BCHE P06276 2/20 0.32
▸ ACHE P22303 2/20 0.32
▸ CES1 P23141 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 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
SCHEMBL1890738 0.76 MAPT (0.44) AURKAAURKBMEN1ALDH1A1MAPT
SCHEMBL9518440 0.70 DDAH1 (0.39) AURKAAURKBMEN1ALDH1A1MAPT
SCHEMBL13954373 0.66 CES2 (0.53) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL6618539 0.65 MEN1 (0.38) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL10946387 0.65 MAPT (0.44) AURKAAURKBMEN1ALDH1A1MAPT
SCHEMBL9654631 0.65 AURKA (0.34) AURKAAURKBMEN1ALDH1A1MAPT
SCHEMBL57290 0.65 MEN1 (0.56) AURKAAURKBMEN1ALDH1A1MAPT
SCHEMBL4911549 0.65 MEN1 (0.47) AURKAAURKBMEN1ALDH1A1MAPT
SCHEMBL9928465 0.63 MEN1 (0.42) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL9653460 0.63 CYP2D6 (0.44) AURKAAURKBMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1828759-A1 BIOSENSORS COMPRISING SEMICONDUCTING ELECTRODES OR RUTHENIUM CONTAINING MEDIATORS AND METHOD OF USING THE SAME Home Diagnostics, Inc. (US) 2007-09-05 — — EP disclosed
WO-2006057722-A1 BIOSENSORS COMPRISING SEMICONDUCTING ELECTRODES OR RUTHENIUM CONTAINING MEDIATORS AND METHOD OF USING THE SAME HOME DIAGNOSTICS, INC. (US) 2006-06-01 — — WO disclosed
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