SCHEMBL12352775

SCHEMBL12352775

CCC(C)(CC)Oc1ccc(C2(c3ccc(OC(=O)c4ccc(C(=O)C(C)(CC)CC)cc4)cc3)CCCCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.57
▸ SLC6A4 P31645 6/20 0.37
▸ SLC6A3 Q01959 6/20 0.37
▸ SLC6A2 P23975 4/20 0.37
▸ TDP1 Q9NUW8 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ RARA P10276 2/20 0.33
▸ RARB P10826 2/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ PRSS1 P07477 2/20 0.32
▸ ACR P10323 2/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ PSMB1 P20618 1/20 0.32
▸ PSMB5 P28074 1/20 0.32
▸ PSMB2 P49721 1/20 0.32

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
SCHEMBL2760061 0.88 ADORA3 (0.60) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL12412338 0.87 ADORA3 (0.57) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL14160487 0.84 ADORA3 (0.60) ADORA3SLC6A4SLC6A3SLC6A2MAPT
SCHEMBL12473086 0.83 ADORA3 (0.57) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL21686392 0.81 ADORA3 (0.43) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL21318616 0.81 ADORA3 (0.54) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL12472031 0.81 ADORA3 (0.54) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL13660290 0.80 ADORA3 (0.50) ADORA3SLC6A4SLC6A3SLC6A2TDP1
SCHEMBL14643611 0.80 ADORA3 (0.60) ADORA3SLC6A4SLC6A3SLC6A2MAPT
SCHEMBL10046812 0.79 ADORA3 (0.60) ADORA3SLC6A4SLC6A3SLC6A2TDP1

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-20110189603-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR AND MANUFACTURING METHOD THEREOF FUJI ELECTRIC SYSTEMS CO., LTD. (JP) 2011-08-04 — — US disclosed
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