SCHEMBL7793178

SCHEMBL7793178

Cc1c(OCc2ccccc2)cccc1[Mg]Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.69
TDP1 Q9NUW8 2/20 0.69
L3MBTL1 Q9Y468 2/20 0.69
MAPK1 P28482 1/20 0.69
HTR6 P50406 1/20 0.48
MAPK14 Q16539 2/20 0.48
LIPE Q05469 1/20 0.46
PTGER1 P34995 1/20 0.46
EDNRA P25101 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTR1A P08908 4/20 0.44
DRD2 P14416 1/20 0.44
ADRA1D P25100 3/20 0.43
ADRA1A P35348 3/20 0.43
ADRA1B P35368 3/20 0.43
LTA4H P09960 1/20 0.41
BRD4 O60885 2/20 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
SCHEMBL19612191 0.82 MAPT (1.00) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL7793196 0.78 MAPT (0.76) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL2880443 0.78 MAPT (0.81) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL9007487 0.77 MAPT (0.80) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL1253794 0.76 MAPT (0.85) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL7450789 0.75 MAPT (0.71) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL13154292 0.75 MAPT (0.76) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL16550786 0.75 MAPT (0.76) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL1142249 0.75 MAPT (0.76) MAPTTDP1L3MBTL1MAPK1HTR6
SCHEMBL19086324 0.75 TDP1 (0.76) MAPTTDP1L3MBTL1MAPK1HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0857713-B1 Process for the preparation of 3-hydroxy- and 3-acetoxy-2-methylbenzoic acid CLARIANT GMBH (DE) 2001-06-13 EP claimed
US-5910605-A Process for the preparation of 3-hydroxy-2-methylbenzoic acid and 3-acetoxy-2-methylbenzoic CLARIANT GMBH (DE) 1999-06-08 US claimed
EP-0857713-A1 Process for the preparation of 3-hydroxy- and 3-acetoxy-2-methylbenzoic acid Clariant GmbH (DE) 1998-08-12 EP claimed
EP-0857713-B1 Process for the preparation of 3-hydroxy- and 3-acetoxy-2-methylbenzoic acid CLARIANT GMBH (DE) 2001-06-13 EP disclosed
US-5910605-A Process for the preparation of 3-hydroxy-2-methylbenzoic acid and 3-acetoxy-2-methylbenzoic CLARIANT GMBH (DE) 1999-06-08 US disclosed
US-5910605-A Process for the preparation of 3-hydroxy-2-methylbenzoic acid and 3-acetoxy-2-methylbenzoic CLARIANT GMBH (DE) 1999-06-08 US disclosed
EP-0857713-A1 Process for the preparation of 3-hydroxy- and 3-acetoxy-2-methylbenzoic acid Clariant GmbH (DE) 1998-08-12 EP disclosed
EP-0857713-A1 Process for the preparation of 3-hydroxy- and 3-acetoxy-2-methylbenzoic acid Clariant GmbH (DE) 1998-08-12 EP disclosed