SCHEMBL11285381

SCHEMBL11285381

C1=CCc2c(OCc3ccccc3)ccc(OCc3ccccc3)c2C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HTR1A P08908 4/20 0.47
DRD2 P14416 1/20 0.47
LIPE Q05469 1/20 0.46
LTA4H P09960 1/20 0.44
MAPK14 Q16539 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
ALPG P10696 1/20 0.43
PTK2B Q14289 1/20 0.43
KDM1A O60341 2/20 0.43
TSHR P16473 1/20 0.43
SLC6A2 P23975 3/20 0.42
SLC6A3 Q01959 3/20 0.42
SLC6A4 P31645 2/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL30892449 0.84 MAPT (0.51) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL11605666 0.84 MAPT (0.51) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL16855019 0.79 MAPT (0.50) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL339812 0.75 MAPT (0.71) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL16347731 0.74 RAB9A (0.46) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL30041677 0.74 KDM1A (0.52) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL416462 0.74 MAPT (0.57) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL29380769 0.74 MAPT (0.57) MAPTL3MBTL1MAPK1TDP1HTR1A
SCHEMBL31643697 0.73 LMNA (0.47) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL9007487 0.72 MAPT (0.80) MAPTL3MBTL1MAPK1TDP1HTR1A

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-0007403-B1 5,12-DIHYDROXY-1,2,3,4,6,11-HEXAHYDRO-2,6,11-TRIOXONAPHTHACENES AND THEIR SYNTHESIS THE UNIVERSITY OF KANSAS (US) 1982-11-24 EP claimed
US-4244880-A Anthracycline synthesis UNIVERSITY OF KANSAS ENDOWMENT ASSOCIATION (US) 1981-01-13 US claimed
EP-0007403-A1 5,12-dihydroxy-1,2,3,4,6,11-hexahydro-2,6,11-trioxonaphthacenes and their synthesis THE UNIVERSITY OF KANSAS (US) 1980-02-06 EP claimed
EP-0007403-B1 5,12-DIHYDROXY-1,2,3,4,6,11-HEXAHYDRO-2,6,11-TRIOXONAPHTHACENES AND THEIR SYNTHESIS THE UNIVERSITY OF KANSAS (US) 1982-11-24 EP disclosed
EP-0043435-A1 Intermediate products occurring in anthracycline synthesis THE UNIVERSITY OF KANSAS (US) 1982-01-13 EP disclosed
US-4244880-A Anthracycline synthesis UNIVERSITY OF KANSAS ENDOWMENT ASSOCIATION (US) 1981-01-13 US disclosed
EP-0007404-A1 Synthesis of 2-hydroxy-2-acetyl-1,2,3,4-tetrahydronaphthalene compounds THE UNIVERSITY OF KANSAS (US) 1980-02-06 EP disclosed
EP-0007403-A1 5,12-dihydroxy-1,2,3,4,6,11-hexahydro-2,6,11-trioxonaphthacenes and their synthesis THE UNIVERSITY OF KANSAS (US) 1980-02-06 EP disclosed