SCHEMBL13780445

SCHEMBL13780445

CCC1=C/C(=C/C=C2/C=C(C)C(=O)C(OC)=C2)C=C(OC)C1=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.50
ALOX5 P09917 14/20 0.39
PTGS2 P35354 5/20 0.39
GLS2 Q9UI32 1/20 0.38
HKDC1 Q2TB90 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TEK Q02763 1/20 0.35
IDO1 P14902 1/20 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
SCHEMBL13780443 0.97 TYR (0.50) TYRALOX5PTGS2GLS2HKDC1
SCHEMBL13780444 0.88 TYR (0.47) TYRALOX5PTGS2GLS2
SCHEMBL13780438 0.87 TYR (0.64) TYRALOX5PTGS2HKDC1KDM4E
SCHEMBL13780463 0.85 ALOX5 (0.55) TYRALOX5PTGS2GLS2
SCHEMBL13780447 0.85 TYR (0.68) TYRALOX5PTGS2HKDC1KDM4E
SCHEMBL13780428 0.85 TYR (0.62) TYRALOX5PTGS2HKDC1KDM4E
SCHEMBL13780441 0.83 PTGS1 (0.32) TYRALOX5
SCHEMBL13780437 0.81 PTGS1 (0.31) TYRALOX5
SCHEMBL13780459 0.80 ALOX5 (0.62) ALOX5PTGS2GLS2
SCHEMBL13780471 0.75 TYR (0.50) TYRALOX5PTGS2HKDC1KDM4E

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