SCHEMBL13780468

SCHEMBL13780468

CCCCCCCCC1=C/C(=C\C=C2/C=C(CCCCCCCC)C(=O)C(C(C)C)=C2)C=C(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 16/20 0.39
PTGS2 P35354 4/20 0.39
PTPN1 P18031 1/20 0.39
GLS2 Q9UI32 1/20 0.39
ACHE P22303 1/20 0.37
BACE1 P56817 1/20 0.37
STAT3 P40763 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MPEG1 Q2M385 3/20 0.31

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
SCHEMBL13780453 0.89 ALOX5 (0.46) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL13780470 0.86 ALOX5 (0.44) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL13780449 0.85 ALOX5 (0.43) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL13780448 0.83 ALOX5 (0.42) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL13780461 0.81 ALOX5 (0.38) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL13780456 0.79 ALOX5 (0.39) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL13780459 0.79 ALOX5 (0.62) ALOX5PTGS2GLS2MPEG1
SCHEMBL13780462 0.77 ALOX5 (0.36) ALOX5PTGS2PTPN1GLS2ACHE
SCHEMBL17969768 0.75 EEF2K (0.41) PTPN1ALDH1A1MAPT
SCHEMBL25814999 0.73 ALOX5 (0.43) ALOX5PTGS2PTPN1GLS2ACHE

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
US-7560207-B2 Organic photoreceptor and electrophotographic image forming apparatus including the photoreceptor SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-07-14 US disclosed
US-20080014519-A1 Organic photoreceptor and electrophotographic image forming apparatus including the photoreptor SAMSUNG ELECTRONICS CO., LTD. 2008-01-17 US disclosed