SCHEMBL2409148

SCHEMBL2409148

CC(C)(C)C(Cc1cn(S(=O)(=O)c2cnn(C(F)F)c2)c(-c2cccnc2F)c1F)NC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33
KIT P10721 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL2413757 0.91 SLC6A9 (0.35) MMP2MMP9MMP8MMP13
SCHEMBL2417224 0.90 JAK3 (0.34)
SCHEMBL2194752 0.88 MMP2 (0.33) MMP2MMP9MMP8MMP13
SCHEMBL2411039 0.88 ABCC9 (0.34) MMP2MMP9MMP8MMP13
SCHEMBL2409439 0.87 MMP2 (0.33) MMP2MMP9MMP8MMP13
SCHEMBL2192366 0.86 DCTPP1 (0.31) MMP2MMP9MMP8MMP13
SCHEMBL2193352 0.86 NAMPT (0.32) MMP2MMP9MMP8MMP13
SCHEMBL2195124 0.86 RORC (0.32) MMP2MMP9MMP8MMP13
SCHEMBL2407582 0.85 MET (0.38) MMP2MMP9MMP8MMP13
SCHEMBL2415904 0.85 IDE (0.32) MMP2MMP9MMP8MMP13

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
EP-2364979-A1 Pyrrole compounds Takeda Pharmaceutical Company Limited (JP) 2011-09-14 EP disclosed