SCHEMBL10826185

SCHEMBL10826185

CCCCCCC(=O)C=Cc1ccc(OCc2ccccc2)c(OC)c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 10/20 0.66
▸ TOP2A P11388 1/20 0.62
▸ ALOX5 P09917 1/20 0.62
▸ HPGD P15428 3/20 0.61
▸ KDM4E B2RXH2 3/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ HTT P42858 1/20 0.61
▸ LMNA P02545 1/20 0.59
▸ HTR1A P08908 1/20 0.59
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ PDE4A P27815 1/20 0.57
▸ PDE4B Q07343 1/20 0.57
▸ PDE4C Q08493 1/20 0.57
▸ PDE4D Q08499 1/20 0.57

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
SCHEMBL10826184 1.00 APP (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10826833 0.95 KDM4E (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10825852 0.95 KDM4E (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10826117 0.95 KDM4E (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10826115 0.95 KDM4E (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10825853 0.95 KDM4E (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10826836 0.95 KDM4E (0.66) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10826116 0.93 KDM4E (0.67) APPTOP2AALOX5HPGDKDM4E
SCHEMBL10826118 0.93 KDM4E (0.67) APPTOP2AALOX5HPGDKDM4E
SCHEMBL8162302 0.90 ALOX5 (0.76) APPALOX5HPGDKDM4EALDH1A1

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-4618627-A ALLERGIES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-10-21 — — US disclosed
EP-0125919-A2 Catechol derivatives, their production and intermediates therefor, and pharmaceutical compositions containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1984-11-21 — — EP disclosed
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