SCHEMBL17040394

SCHEMBL17040394

Cc1ccc(C(c2ccc(-c3ccc(-c4ccc(/C=C5\SC(=S)N(CC(=O)O)C5=O)s4)s3)cc2)c2ccc(-c3ccc(-c4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)s4)s3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTPN22 Q9Y2R2 5/20 0.61
▸ MAPT P10636 3/20 0.51
▸ PKM P14618 1/20 0.51
▸ PTPN1 P18031 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ GALK1 P51570 1/20 0.51
▸ MCL1 Q07820 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ PTPN12 Q05209 1/20 0.47
▸ AKR1B1 P15121 1/20 0.46

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
SCHEMBL12661930 0.89 PTPN22 (0.61) PTPN22MAPTPKMPTPN1MAPK1
SCHEMBL12661929 0.87 PTPN22 (0.63) PTPN22MAPTPKMPTPN1MAPK1
SCHEMBL14773208 0.83 PTPN22 (0.59) PTPN22MAPTPKMPTPN1MAPK1
SCHEMBL12661919 0.83 PTPN22 (0.66) PTPN22KMT2APTPN12
SCHEMBL13056341 0.83 PTPN22 (0.70) PTPN22PTPN1MEN1KMT2APOLB
SCHEMBL13056344 0.82 PTPN22 (0.70) PTPN22MAPTMEN1KMT2APOLB
SCHEMBL12673285 0.81 PTPN22 (0.53) PTPN22MAPTPKMPTPN1MAPK1
SCHEMBL12661916 0.81 PTPN22 (0.68) PTPN22KMT2APTPN12
SCHEMBL6785696 0.79 PTPN22 (0.72) PTPN22
SCHEMBL12673226 0.78 PTPN22 (0.53) PTPN22MAPTPKMPTPN1MAPK1

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
US-20150243445-A1 PHOTOELECTRIC CONVERSION ELEMENT AND METHOD FOR PRODUCING THE SAME Konica Minolta, Inc. (JP) 2015-08-27 — — US disclosed
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