SCHEMBL13569438

SCHEMBL13569438

C=CC(=O)OC(COC(=O)C(=C)C)COc1ccc(-c2ccc(N(c3ccc(C)c(C)c3)c3ccc(C)c(C)c3)cc2C)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
MAPK1 P28482 1/20 0.32
ESR2 Q92731 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL13569433 0.91 KDM4E (0.32) POLB
SCHEMBL13569397 0.90 AR (0.32) POLBAPEX1TDP1AR
SCHEMBL13569429 0.90 PDK2 (0.30)
SCHEMBL13569434 0.82 MAOA (0.32) AR
SCHEMBL13569437 0.82 PDK2 (0.30)
SCHEMBL13778854 0.81 NPC1 (0.34) POLBTDP1L3MBTL1AR
SCHEMBL13569435 0.81 MCHR1 (0.34) MAPT
SCHEMBL13569436 0.80 HPGD (0.31) HPGD
SCHEMBL13569404 0.80 AR (0.34) POLBAPEX1MAPK1TDP1MAPT
SCHEMBL13569446 0.80 PDK2 (0.34)

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-7629094-B2 Electrophotographic photoreceptor, and image forming method, image forming apparatus and process cartridge therefor using the electrophotographic photoreceptor RICOH COMPANY, LTD. (JP) 2009-12-08 US disclosed