SCHEMBL5510022

SCHEMBL5510022

CSc1ccccc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.58
MAPK1 P28482 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LIPE Q05469 1/20 0.53
HTR1A P08908 4/20 0.50
DRD2 P14416 1/20 0.50
LMNA P02545 1/20 0.49
LTA4H P09960 1/20 0.47
MAPK14 Q16539 1/20 0.47
ADRA1D P25100 3/20 0.46
ADRA1A P35348 3/20 0.46
ADRA1B P35368 3/20 0.46
BRD4 O60885 2/20 0.46
GAA P10253 1/20 0.46
ALPG P10696 1/20 0.46
PTK2B Q14289 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL9445678 0.84 MAPT (0.57) MAPTMAPK1TDP1L3MBTL1LIPE
SCHEMBL11158607 0.81 LMNA (0.47) MAPTMAPK1TDP1L3MBTL1LIPE
SCHEMBL27153905 0.81 MAPT (0.54) MAPTMAPK1TDP1L3MBTL1LIPE
SCHEMBL24697569 0.80 CCR5 (0.53) MAPTMAPK1TDP1L3MBTL1LMNA
SCHEMBL30015397 0.80 CCR5 (0.53) MAPTMAPK1TDP1L3MBTL1LMNA
SCHEMBL339812 0.79 MAPT (0.71) MAPTMAPK1TDP1L3MBTL1LIPE
SCHEMBL11847000 0.78 ALDH1A1 (0.52) MAPTTDP1L3MBTL1LMNAGAA
SCHEMBL24244923 0.77 GSTP1 (0.51) MAPTL3MBTL1LMNAGAASMN1; SMN2
SCHEMBL13049318 0.76 SLC6A9 (0.54) MAPTMAPK1TDP1L3MBTL1LIPE
SCHEMBL11848917 0.76 SLC6A2 (0.40) MAPTTDP1L3MBTL1LMNAGAA

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
EP-1771816-A1 A MULTIFUNCTION, DIRECT THERMAL RECORDING MATERIAL Kanzaki Specialty Papers Inc. (US) 2007-04-11 EP disclosed
WO-2006005000-A1 A MULTIFUNCTION, DIRECT THERMAL RECORDING MATERIAL KANZAKI SPECIALTY PAPERS INC. (US) 2006-01-12 WO disclosed