SCHEMBL2599352

SCHEMBL2599352

CCCC(=O)CS(=O)(=O)Nn1c(=O)[nH]c2cc(C(F)(F)F)c(C(CC)OC)cc2c1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 1/20 0.34
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
KDM4E B2RXH2 4/20 0.32
HSD17B10 Q99714 4/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
AR P10275 1/20 0.32
LMNA P02545 1/20 0.31
MPO P05164 1/20 0.31
XDH P47989 1/20 0.31
POLB P06746 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
SCHEMBL2597158 0.85 DDR1 (0.36) DDR1CA12CA9ARMPO
SCHEMBL2599374 0.83 DDR1 (0.39) DDR1CA12CA9KDM4EHSD17B10
SCHEMBL1661191 0.82 DDR1 (0.35) DDR1CA12CA9AR
SCHEMBL2597309 0.78 DDR1 (0.35) DDR1CA12CA9KDM4EHSD17B10
SCHEMBL958028 0.77 DDR1 (0.35) DDR1CA12CA9AR
SCHEMBL1001067 0.77 DDR1 (0.36) DDR1CA12CA9KDM4EALDH1A1
SCHEMBL2597153 0.77 DDR1 (0.35) DDR1CA12CA9KDM4EHSD17B10
SCHEMBL1661057 0.76 AR (0.36) DDR1CA12CA9ARLMNA
SCHEMBL2597372 0.76 KDM4E (0.36) DDR1CA12CA9KDM4EHSD17B10
SCHEMBL12180486 0.76 DDR1 (0.36) DDR1CA12CA9KDM4EHSD17B10

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-2571865-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES Novartis AG (CH) 2013-03-27 EP disclosed
WO-2011144666-A1 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES NOVARTIS AG (CH) 2011-11-24 WO disclosed