SCHEMBL7004697

SCHEMBL7004697

NC(=O)CCN(CCCCCCNc1nsc2nccn12)S(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 10/20 0.51
TGM1 P22735 4/20 0.47
NR3C2 P08235 1/20 0.34
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
SYK P43405 1/20 0.31
ZAP70 P43403 1/20 0.30
KARS1 Q15046 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
KAT6A Q92794 1/20 0.30
GRM4 Q14833 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
SCHEMBL7002966 0.93 F13A1 (0.52) F13A1TGM1NR3C2LMNAPKM
SCHEMBL7004258 0.91 F13A1 (0.52) F13A1TGM1NR3C2LMNAPKM
SCHEMBL7010746 0.88 F13A1 (0.48) F13A1TGM1NR3C2KAT6A
SCHEMBL7005895 0.86 F13A1 (0.48) F13A1TGM1NR3C2KAT6A
SCHEMBL7009658 0.81 F13A1 (0.67) F13A1TGM1NR3C2LMNAPKM
SCHEMBL7004703 0.79 F13A1 (0.52) F13A1TGM1NR3C2HDAC1HDAC8
SCHEMBL7005996 0.79 F13A1 (0.54) F13A1TGM1
SCHEMBL7004255 0.76 F13A1 (0.48) F13A1TGM1NR3C2
SCHEMBL7005641 0.74 F13A1 (0.65) F13A1TGM1NR3C2PKM
SCHEMBL7007196 0.74 F13A1 (0.54) F13A1TGM1

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-1348710-A1 Sulfonamide derivatives of 3-substituted imidazo[1,2-D]-1,2,4-thiadiazoles and 3-substituted-[1,2,4]thiadiazolo[4,5-A]benzimidazole as inhibitors of fibrin cross-linking and transglutaminases Apotex Inc. (CA) 2003-10-01 EP disclosed