SCHEMBL6556302

SCHEMBL6556302

CCOC(Cn1c(-c2cccs2)ncc(NC(=O)OCc2ccccc2)c1=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.62
HDAC3 O15379 2/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 2/20 0.48

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
SCHEMBL7296453 0.91 ELANE (0.64) ELANEHDAC3HDAC1HDAC2
SCHEMBL6557678 0.87 ELANE (0.60) ELANE
SCHEMBL6556313 0.86 ELANE (0.55) ELANE
SCHEMBL6556060 0.85 ELANE (0.51) ELANE
SCHEMBL27467031 0.85 ELANE (0.49) ELANE
SCHEMBL6558195 0.85 ELANE (0.55) ELANE
SCHEMBL6556446 0.85 ELANE (0.69) ELANEHDAC3HDAC1HDAC2
SCHEMBL6556275 0.84 ELANE (0.57) ELANE
SCHEMBL6558300 0.83 ELANE (0.63) ELANE
SCHEMBL6557643 0.83 ELANE (0.64) ELANE

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
EP-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed