SCHEMBL806586

SCHEMBL806586

COc1ccc(Cl)cc1NC(=O)CN(c1cccc(Cl)c1Cl)S(C)(=O)=O

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.77
▸ GAA P10253 4/20 0.66
▸ MEN1 O00255 3/20 0.66
▸ KMT2A Q03164 3/20 0.66
▸ NPSR1 Q6W5P4 3/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ MAPT P10636 4/20 0.58
▸ MAPK1 P28482 1/20 0.57
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ HTT P42858 1/20 0.56

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
SCHEMBL806585 0.78 POLB (0.69) POLBGAAMEN1KMT2ANPSR1
SCHEMBL17340116 0.75 KMT2A (0.58) POLBGAAMEN1KMT2ANPSR1
SCHEMBL24445724 0.74 MAPT (0.66) POLBGAAMEN1KMT2ANPSR1
SCHEMBL31222507 0.74 MAPT (0.66) POLBGAAMEN1KMT2ANPSR1
SCHEMBL2011023 0.73 MEN1 (1.00) POLBMEN1KMT2ANPSR1ALDH1A1
SCHEMBL806582 0.71 GAA (0.66) POLBGAAMEN1KMT2ANPSR1
SCHEMBL14192656 0.71 KMT2A (0.82) POLBMEN1KMT2ANPSR1ALDH1A1
SCHEMBL9468747 0.71 KMT2A (0.82) POLBMEN1KMT2ANPSR1ALDH1A1
SCHEMBL12300221 0.71 MEN1 (0.82) POLBMEN1KMT2ANPSR1ALDH1A1
SCHEMBL16384054 0.70 HTT (0.73) POLBGAAMEN1KMT2AALDH1A1

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
US-9212134-B2 Inhibitors of viral entry into mammalian cells MICROBIOTIX, INC. (US) 2015-12-15 — — US disclosed
WO-2012037119-A2 INHIBITORS OF VIRAL ENTRY INTO MAMMALIAN CELLS MICROBIOTIX, INC. (US) 2012-03-22 — — WO disclosed
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