SCHEMBL5593159

SCHEMBL5593159

Cc1ncc(NC(=O)c2cc(F)cc(N3CCOCC3)c2)cc1-c1cc(C(=O)O)on1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 16/20 0.51
BRAF P15056 15/20 0.51
PLAU P00749 1/20 0.47
MAPK14 Q16539 3/20 0.46

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
SCHEMBL4551205 0.89 RAF1 (0.62) RAF1BRAFMAPK14
SCHEMBL4410361 0.88 RAF1 (0.49) RAF1BRAFMAPK14
SCHEMBL4408603 0.88 RAF1 (0.48) RAF1BRAF
SCHEMBL5602980 0.84 RAF1 (0.54) RAF1BRAF
SCHEMBL5623710 0.84 RAF1 (0.50) RAF1BRAFPLAU
SCHEMBL15074587 0.82 PLAU (0.57) RAF1BRAFPLAUMAPK14
SCHEMBL5593026 0.81 RAF1 (0.61) RAF1BRAFMAPK14
SCHEMBL5593279 0.80 RAF1 (0.50) RAF1BRAFPLAUMAPK14
SCHEMBL4781325 0.80 RAF1 (0.55) RAF1BRAF
SCHEMBL15070867 0.79 PLAU (0.52) RAF1BRAFPLAUMAPK14

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-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed