SCHEMBL3811151

SCHEMBL3811151

O=C(CNc1cc(-c2ccccc2)sc1C(=O)O)c1sccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.50
▸ PTPRF P10586 1/20 0.50
▸ PTPRA P18433 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ CRHBP P24387 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CRHR2 Q13324 1/20 0.44
▸ IKBKB O14920 2/20 0.43
▸ IGF2BP2 Q9Y6M1 1/20 0.41

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
SCHEMBL2250633 0.83 PTPN1 (0.52) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2251143 0.81 PTPN1 (0.50) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2158083 0.81 PTPN1 (0.58) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2254388 0.81 PTPN1 (0.52) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2252377 0.81 PTPN1 (0.55) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2247145 0.81 PTPN1 (0.49) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL3816825 0.80 MCL1 (0.54) PTPN1PTPRFMAPTKMT2A
SCHEMBL2158011 0.76 PTPN1 (0.47) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2251240 0.76 PTPN1 (0.47) PTPN1PTPRFPTPRAMAPTMEN1
SCHEMBL2250470 0.76 PTPN1 (0.52) PTPN1PTPRFPTPRAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401825-B1 THIOPHENE DERIVATIVES AS ANTIVIRAL AGENTS FOR FLAVIVIRUS INFECTION VIROCHEM PHARMA INC (CA) 2009-08-05 — — EP claimed
CN-100509797-C Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2009-07-08 — — CN claimed
US-6881741-B2 Compounds and methods for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-04-19 — — US claimed
CN-1602308-A Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2005-03-30 — — CN claimed
CN-101624391-A Thiophene derivatives as antiviral agents for flavivirus infection VIROCHEM PHARMA INC 2010-01-13 — — CN disclosed
CN-100509797-C Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2009-07-08 — — CN disclosed
CN-1602308-A Thiophene derivatives as antiviral agents against flavivirus infections VIRUS CHEM PHARMA INC (CA) 2005-03-30 — — CN disclosed
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