SCHEMBL4565879

SCHEMBL4565879

Cc1ncc(NC(=O)c2cc(F)cc(N3CCOCC3)c2)cc1C(=O)Nc1ccc(NCC2CCCO2)nc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.47
TNK2 Q07912 1/20 0.45
RAF1 P04049 2/20 0.44
BRAF P15056 2/20 0.44
PLAU P00749 1/20 0.43
HCAR3 P49019 1/20 0.43
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43

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
SCHEMBL4551790 0.96 HCAR3 (0.45) MAPK14TNK2HCAR3
SCHEMBL4551562 0.95 HCAR3 (0.44) MAPK14TNK2HCAR3
SCHEMBL5484352 0.91 CSF1R (0.50) MAPK14TNK2RAF1BRAF
SCHEMBL4408418 0.90 CRHR1 (0.48) MAPK14RAF1BRAFPLAUMAPK13
SCHEMBL5490162 0.90 TNK2 (0.44) MAPK14TNK2RAF1BRAFHCAR3
SCHEMBL14534670 0.90 MAPK14 (0.46) MAPK14RAF1BRAFPLAUMAPK13
SCHEMBL5487361 0.90 MAPK14 (0.47) MAPK14RAF1BRAFPLAUMAPK13
SCHEMBL5490935 0.88 CRHR1 (0.45) MAPK14RAF1BRAFPLAUMAPK13
SCHEMBL4551651 0.87 CRHR1 (0.45) MAPK14RAF1BRAFPLAUMAPK13
SCHEMBL14534471 0.86 MAPK14 (0.50) MAPK14RAF1BRAFPLAUMAPK13

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 4 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-2007056016-A2 BISAMIDE CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-05-18 WO disclosed
WO-2007056016-A2 BISAMIDE CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-05-18 WO disclosed