SCHEMBL4755945

SCHEMBL4755945

CCc1n[c]nc2cccc(C)c12

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.35
PARP1 P09874 2/20 0.34

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
SCHEMBL23295733 0.79 ELANE (0.39) ELANEPARP1
SCHEMBL4756470 0.70 USP8 (0.36) ELANEPARP1
SCHEMBL4757324 0.69 ELANE (0.33) ELANEPARP1
SCHEMBL2975857 0.67 TLR8 (0.38) ELANEPARP1
SCHEMBL5213764 0.67 POLB (0.45)
SCHEMBL8479997 0.66 GAA (0.34)
SCHEMBL11627568 0.62 ELANE (0.45) ELANEPARP1
SCHEMBL12593579 0.62 MAPK1 (0.49)
SCHEMBL28166591 0.62 ELANE (0.46) ELANEPARP1
SCHEMBL7182976 0.61 ELANE (0.53) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008154905-A2 MODIFICATIONS OF THE HISTONE DEACETYLASE INHIBITOR SUBEROYLANILIDE HYDROXAMIC ACID SCHEBO BIOTECH AG (DE) 2008-12-24 WO disclosed