SCHEMBL5572974

SCHEMBL5572974

CCOc1cccc(COC)c1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 5/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 2/20 0.40
BLM P54132 2/20 0.40
MEN1 O00255 1/20 0.40
THRB P10828 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
PLEC Q15149 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 1/20 0.39

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
SCHEMBL27981326 0.85 L3MBTL1 (0.55) ABCB1ABCG2ALDH1A1KDM4EMAPT
SCHEMBL4369269 0.85 ABCB1 (0.57) ABCB1ABCG2ALDH1A1KDM4EL3MBTL1
SCHEMBL19612335 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL2353503 0.82 ALDH1A1 (0.47) ABCB1ABCG2ALDH1A1KDM4EMAPT
SCHEMBL7959739 0.81 L3MBTL1 (0.58) ABCB1ALDH1A1MAPTL3MBTL1NPSR1
SCHEMBL1252231 0.79 ALDH1A1 (0.48) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL1252234 0.79 TAAR1 (0.56) ABCB1ABCG2ALDH1A1KDM4EMAPT
SCHEMBL12129060 0.79 SMN1; SMN2 (0.57) ABCB1ALDH1A1KDM4EMAPTL3MBTL1
SCHEMBL10194649 0.79 L3MBTL1 (0.43) ALDH1A1KDM4EMAPTL3MBTL1NPSR1
SCHEMBL16534556 0.79 IDO1 (0.51) ALDH1A1KDM4EMAPTL3MBTL1NPSR1

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-20070254185-A1 Organic EL display device and organic thin film device HITACHI DISPLAYS, LTD. (JP) 2007-11-01 US disclosed