SCHEMBL30877397

SCHEMBL30877397

Cc1ccc(S(=O)(=O)n2cc(Cl)cc2-c2scnc2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
HTT P42858 2/20 0.39
POLB P06746 2/20 0.39
ALDH3A1 P30838 1/20 0.39
NOD1 Q9Y239 1/20 0.39
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
KDM4E B2RXH2 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KLK7 P49862 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
UBE2N P61088 1/20 0.34
HSD11B1 P28845 1/20 0.34
HPGD P15428 1/20 0.34
PDE4A P27815 1/20 0.34

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
SCHEMBL30877459 0.77 ALDH1A1 (0.45) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877326 0.77 ALDH1A1 (0.42) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877446 0.75 ALDH1A1 (0.40) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877423 0.74 ALDH1A1 (0.39) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877462 0.73 ALDH1A1 (0.42) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877425 0.73 ALDH1A1 (0.44) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL28733308 0.73 ALDH1A1 (0.47) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877448 0.72 ALDH1A1 (0.46) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877451 0.72 ALDH1A1 (0.43) ALDH1A1L3MBTL1HTTPOLBALDH3A1
SCHEMBL30877303 0.72 ALDH1A1 (0.43) ALDH1A1L3MBTL1HTTPOLBALDH3A1

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
CN-117964643-B Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof 苏州朗睿生物医药有限公司 2024-07-02 CN disclosed
CN-117964643-A Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof 苏州朗睿生物医药有限公司 2024-05-03 CN disclosed