SCHEMBL3679429

SCHEMBL3679429

CC1=CC(=O)N(c2cc(C)cc(N3C(=O)C=C(C)C3=O)c2C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 2/20 0.36
HSP90AA1 P07900 1/20 0.36
XPO1 O14980 1/20 0.33
LMNA P02545 1/20 0.32
CA1 P00915 1/20 0.30
CA9 Q16790 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
SCHEMBL3680070 0.82 MGLL (0.33)
SCHEMBL3679861 0.80 MGLL (0.38) HSP90AA1XPO1
SCHEMBL3684376 0.79 HPGD (0.34) CCR6HSP90AA1XPO1
SCHEMBL3681498 0.78 CCR6 (0.33) CCR6HSP90AA1
SCHEMBL8885075 0.78 HSP90AA1 (0.52) CCR6HSP90AA1XPO1LMNA
SCHEMBL27902918 0.78 HSP90AA1 (0.57) CCR6HSP90AA1XPO1LMNA
SCHEMBL8439731 0.77 LMNA (0.41) LMNA
SCHEMBL7193393 0.75 TLR9 (0.48) XPO1
SCHEMBL2230828 0.74 MGLL (0.50) CCR6HSP90AA1XPO1
SCHEMBL3684380 0.74 CCR6 (0.31) CCR6HSP90AA1

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
US-20100175805-A1 RUBBER COMPOSITION FOR COVERING TEXTILE CORD AND TIRE EMPLOYING THE SAME SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-07-15 US disclosed