SCHEMBL4963797

SCHEMBL4963797

COC(=O)c1cc(C(C)(C)C)cc(NC(=O)C(=O)c2ccc(OCCN3CCOCC3)c3ccccc23)c1OC

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.83
SCARB1 Q8WTV0 10/20 0.80

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
SCHEMBL2069446 0.94 MAPK14 (0.83) MAPK14SCARB1
SCHEMBL1600039 0.93 MAPK14 (0.82) MAPK14SCARB1
SCHEMBL1599792 0.92 MAPK14 (0.84) MAPK14SCARB1
SCHEMBL1599793 0.92 MAPK14 (0.81) MAPK14SCARB1
SCHEMBL1600091 0.92 MAPK14 (0.85) MAPK14SCARB1
SCHEMBL4946846 0.92 MAPK14 (0.84) MAPK14SCARB1
SCHEMBL1599362 0.92 MAPK14 (0.87) MAPK14SCARB1
SCHEMBL4944884 0.92 MAPK14 (0.84) MAPK14SCARB1
SCHEMBL1599482 0.92 MAPK14 (0.84) MAPK14SCARB1
SCHEMBL1599635 0.92 MAPK14 (0.84) MAPK14SCARB1

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-2008089034-A2 CYTOKINE INHIBITORS KEMIA, INC. (US) 2008-07-24 WO disclosed