SCHEMBL13508237

SCHEMBL13508237

COc1ccc(Oc2ccc(Oc3ccc(Cc4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.62
LTA4H P09960 3/20 0.61
MAPT P10636 3/20 0.51
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RELA Q04206 1/20 0.50
ALOX5 P09917 1/20 0.49
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 0.49
IDO1 P14902 1/20 0.48
TEAD4 Q15561 1/20 0.48
ALDH1A1 P00352 2/20 0.47
BCHE P06276 1/20 0.47
POLB P06746 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
NPBWR1 P48145 1/20 0.47
MCHR1 Q99705 1/20 0.47

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
SCHEMBL13079831 1.00 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL14592266 1.00 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL12374454 1.00 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL12190468 1.00 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL12374455 1.00 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13249143 1.00 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13020525 0.94 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13508238 0.94 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13020524 0.94 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13020521 0.94 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1

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-20100036041-A1 MOLDING MATERIALS COMPRISING HIGHLY CROSSLINKED ORGANIC NANOPARTICLES BASF SE (DE) 2010-02-11 US disclosed