SCHEMBL7944048

SCHEMBL7944048

Cc1ccc2c(Cl)cc(S(=O)(=O)O)c(O)c2n1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
KDM4E B2RXH2 6/20 0.46
HTT P42858 3/20 0.46
PKM P14618 1/20 0.46
GAA P10253 1/20 0.44
KMT2A Q03164 5/20 0.44
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.40
OPRK1 P41145 1/20 0.39
LMNA P02545 2/20 0.38
COMT P21964 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL1076730 0.90 MAPT (0.65) MAPTKDM4EHTTPKMGAA
SCHEMBL7690466 0.88 MAPT (0.67) MAPTKDM4EHTTPKMGAA
SCHEMBL7687038 0.87 MAPT (0.65) MAPTKDM4EHTTPKMGAA
SCHEMBL4764600 0.83 MAPT (0.56) MAPTKDM4EHTTPKMGAA
Chlorquinaldol SCHEMBL29607534 0.80 MAPT (1.00) MAPTKDM4EHTTPKMGAA
Chlorquinaldol SCHEMBL29641617 0.80 MAPT (1.00) MAPTKDM4EHTTPKMGAA
Chlorquinaldol SCHEMBL11746430 0.80 MAPT (1.00) MAPTKDM4EHTTPKMGAA
Chlorquinaldol SCHEMBL301405 0.80 MAPT (1.00) MAPTKDM4EHTTPKMGAA
Chlorquinaldol SCHEMBL28904554 0.79 MAPT (0.96) MAPTKDM4EHTTPKMGAA
Chlorquinaldol SCHEMBL28519249 0.79 MAPT (0.96) MAPTKDM4EHTTPKMGAA

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-6211376-B1 HERPES VIRUS, CYTOMEGALO VIRUS, VARICELLA-ZOSTER VIRUS,EPSTEIN-BARR VIRUS PHARMACIA & UPJOHN COMPANY 2001-04-03 US disclosed