SCHEMBL12345973

SCHEMBL12345973

COc1ccc(C(C)(C)c2ccc(OC(=O)CCCCCCCCCCC(C)=O)cc2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MAPT P10636 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RET P07949 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TOP2A P11388 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ SLC22A2 O15244 1/20 0.35
▸ TMPRSS2 O15393 1/20 0.35
▸ F2 P00734 1/20 0.35
▸ F10 P00742 1/20 0.35

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
SCHEMBL14802308 0.92 TOP2A (0.41) L3MBTL1GAATDP1TOP2AHDAC6
SCHEMBL12345944 0.92 TOP2A (0.41) L3MBTL1GAATDP1TOP2AHDAC6
SCHEMBL15001293 0.92 TOP2A (0.41) L3MBTL1GAATDP1TOP2AHDAC6
SCHEMBL15001286 0.92 TOP2A (0.41) L3MBTL1GAATDP1TOP2AHDAC6
SCHEMBL15001297 0.92 TOP2A (0.41) L3MBTL1GAATDP1TOP2AHDAC6
SCHEMBL15001287 0.90 TOP2A (0.40) L3MBTL1GAATOP2AHDAC6
SCHEMBL15001280 0.88 L3MBTL1 (0.40) L3MBTL1GAATOP2AHDAC6
SCHEMBL9999550 0.86 KMT2A (0.46) KMT2AL3MBTL1MAPTHSD17B10ALDH1A1
SCHEMBL12346024 0.86 KMT2A (0.46) KMT2AL3MBTL1MAPTHSD17B10ALDH1A1
SCHEMBL12346026 0.86 KMT2A (0.46) KMT2AL3MBTL1MAPTHSD17B10ALDH1A1

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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