SCHEMBL4551600

SCHEMBL4551600

Cc1ccc(Nc2cc(F)cc(N3CCSCC3)c2)cc1-c1cc(C(=O)NCC(C)(C)C)on1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 7/20 0.39
BRAF P15056 7/20 0.39
SETD2 Q9BYW2 2/20 0.35
CSGALNACT1 Q8TDX6 2/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
MAPK14 Q16539 6/20 0.33
PLAU P00749 1/20 0.33

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
SCHEMBL4551892 0.89 RAF1 (0.44) RAF1BRAFMAPK14PLAU
SCHEMBL4551601 0.89 RAF1 (0.48) RAF1BRAFMAPK14
SCHEMBL5604333 0.88 RAF1 (0.38) RAF1BRAFSETD2CSGALNACT1RAB9A
SCHEMBL4552281 0.86 RAF1 (0.45) RAF1BRAFMAPK14PLAU
SCHEMBL4552240 0.83 RAF1 (0.50) RAF1BRAF
SCHEMBL5593431 0.82 RAF1 (0.49) RAF1BRAFMAPK14
SCHEMBL4551703 0.82 MAPK14 (0.48) RAF1BRAFMAPK14PLAU
SCHEMBL4551200 0.81 CSGALNACT1 (0.44) RAF1BRAFCSGALNACT1RAB9ANPC1
SCHEMBL4565118 0.81 RAF1 (0.56) RAF1BRAFMAPK14
SCHEMBL4410286 0.81 RAF1 (0.49) RAF1BRAFMAPK14

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 2 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