SCHEMBL13671569

SCHEMBL13671569

CC(=O)Oc1cc2c(cc1C)sc1cc(C)c(OC(C)=O)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.47
▸ KDM4E B2RXH2 8/20 0.45
▸ GAA P10253 6/20 0.45
▸ MAPT P10636 5/20 0.45
▸ HSD17B10 Q99714 5/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ GLA P06280 4/20 0.45
▸ CASP1 P29466 3/20 0.45
▸ CASP7 P55210 3/20 0.45
▸ HPGD P15428 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HSP90AA1 P07900 1/20 0.45
▸ HSP90AB1 P08238 1/20 0.45
▸ ALPG P10696 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ ACHE P22303 1/20 0.45
▸ TP53 P04637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.38
▸ ADRA2A P08913 1/20 0.38

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
SCHEMBL14523524 0.89 KDM4E (0.46) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL28376304 0.82 HTT (0.50) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL15867097 0.80 ACHE (0.57) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL9788676 0.76 TNFSF11 (0.55) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL6064319 0.76 ACHE (0.53) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL13342884 0.74 KDM4E (0.61) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL12677587 0.74 HDAC3 (0.45) KDM4EMAPTSMN1; SMN2ACHETSHR
SCHEMBL8081069 0.73 TNFSF11 (0.56) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL26009129 0.72 TNFSF11 (0.57) HTTKDM4EGAAMAPTHSD17B10
SCHEMBL7711467 0.71 ACHE (0.49) HTTKDM4EGAAMAPTHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2107076-A1 Conjugated polymer comprising dibenzothiophene- or dibenzofuran-units and their use in polymer LEDs Sumitomo Chemical Company, Limited (JP) 2009-10-07 — — EP disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 — — US disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 — — US disclosed
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