SCHEMBL3186264

SCHEMBL3186264

O=Nc1ccc(S)cc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
HDAC8 Q9BY41 1/20 0.38
ALDH1A1 P00352 6/20 0.34
ALOX15 P16050 3/20 0.34
CYP1A2 P05177 1/20 0.34
KDR P35968 2/20 0.33
PDE4A P27815 1/20 0.33
BLVRB P30043 1/20 0.33
HTT P42858 1/20 0.33
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
TSHR P16473 3/20 0.32
CA12 O43570 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 2/20 0.32
PTGS2 P35354 2/20 0.32
ALOX5 P09917 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
SCHEMBL11145898 0.78 MEN1 (0.61) MAPTKMT2AMEN1ALDH1A1KDR
SCHEMBL19050355 0.78 MEN1 (0.47) MAPTKMT2AMEN1ALDH1A1ALOX15
SCHEMBL1431441 0.76 ALDH1A1 (0.48) MAPTKMT2AMEN1HDAC8ALDH1A1
SCHEMBL28238985 0.76 KDM4E (0.55) MAPTKMT2AMEN1ALDH1A1ALOX15
SCHEMBL13081781 0.76 KEAP1 (0.55) MAPTKMT2AMEN1ALDH1A1CA1
SCHEMBL19670802 0.76 KDM4E (0.57) MAPTKMT2AMEN1ALDH1A1ALOX15
SCHEMBL9892495 0.76 CSNK2A1 (0.57) KMT2AMEN1ALDH1A1CA1CA2
SCHEMBL28640055 0.74 MAPT (0.54) MAPTKMT2AMEN1HDAC8ALDH1A1
SCHEMBL27793256 0.74 ALDH1A1 (0.46) MAPTKMT2AMEN1HDAC8ALDH1A1
SCHEMBL20834128 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106962452-A A kind of freshwater fish meat antistaling agent and preservation method 河北工程大学 2017-07-21 CN disclosed
US-7803759-B2 S-nitrosoprotein preparation and production method therefor Nipro Corporaton (JP) 2010-09-28 US disclosed
US-7718607-B2 Method of producing S-nitrosoprotein preparation NIPRO CORPORATION (JP) 2010-05-18 US disclosed
US-20080287655-A1 Method of producing s-nitrosoprotein preparation ISHIMA YU 2008-11-20 US disclosed
US-20080051320-A1 S-nitrosoprotein preparation and production method therefor NIPRO CORPORATION (JP) 2008-02-28 US disclosed