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Sugi Predict / Compounds / SCHEMBL4565126

SCHEMBL4565126

SCHEMBL4565126

CCCS(=O)(=O)Nc1cc(C(C)(C)C)cc(NC(=O)C(=O)c2ccc(Nc3ccnc(N(C)C)c3)c3ccccc23)c1OC

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 7/20 0.65
▸ SCARB1 Q8WTV0 13/20 0.58
▸ SRC P12931 1/20 0.47
▸ SYK P43405 1/20 0.47

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
SCHEMBL4571044 0.90 MAPK14 (0.80) MAPK14SCARB1SRCSYK
SCHEMBL1602728 0.88 MAPK14 (0.67) MAPK14SCARB1SRCSYK
SCHEMBL1599964 0.85 SCARB1 (0.67) MAPK14SCARB1SRCSYK
SCHEMBL1600950 0.81 SCARB1 (0.73) MAPK14SCARB1
SCHEMBL4410951 0.81 MAPK14 (0.55) MAPK14SCARB1SRCSYK
SCHEMBL5806276 0.81 MAPK14 (0.58) MAPK14SRCSYK
SCHEMBL5312427 0.79 MAPK14 (1.00) MAPK14SCARB1SRCSYK
SCHEMBL1599989 0.79 SCARB1 (0.66) MAPK14SCARB1
SCHEMBL1598842 0.78 MAPK14 (0.81) MAPK14SCARB1SRCSYK
SCHEMBL4410336 0.77 SCARB1 (0.68) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035005-A2 THERAPY USING CYTOKINE INHIBITORS Kemia, INC. (US) 2009-03-18 — — EP disclosed
WO-2007146712-A2 THERAPY USING CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-12-21 — — WO disclosed
WO-2006091862-A2 CYTOKINE INHIBITORS AND THEIR USE IN THERAPY KEMIA, INC. (US) 2006-08-31 — — WO disclosed