SCHEMBL9865216

SCHEMBL9865216

C=CC(=O)Nc1cc(Br)cc(Br)c1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 11/20 0.68
F13A1 P00488 1/20 0.66
LMNA P02545 1/20 0.66
TGM1 P22735 1/20 0.66
TGM3 Q08188 1/20 0.66
EGFR P00533 5/20 0.49
ACP1 P24666 1/20 0.46
FYN P06241 2/20 0.44
SRC P12931 2/20 0.44
ERBB2 P04626 2/20 0.43
BLK P51451 1/20 0.43
BMX P51813 1/20 0.43
JAK3 P52333 1/20 0.43
BTK Q06187 1/20 0.43
ERBB4 Q15303 1/20 0.43
CYP2C19 P33261 1/20 0.42

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
SCHEMBL16096107 0.87 TGM2 (0.58) TGM2F13A1LMNATGM1TGM3
SCHEMBL28043184 0.87 TGM2 (0.54) TGM2F13A1LMNATGM1TGM3
SCHEMBL16053417 0.84 TGM2 (0.64) TGM2F13A1LMNATGM1TGM3
SCHEMBL30935238 0.83 TGM2 (0.59) TGM2F13A1LMNATGM1TGM3
SCHEMBL1381249 0.81 TGM2 (1.00) TGM2F13A1LMNATGM1TGM3
SCHEMBL29505044 0.81 TGM2 (1.00) TGM2F13A1LMNATGM1TGM3
SCHEMBL24568741 0.80 TGM2 (0.58) TGM2F13A1LMNATGM1TGM3
SCHEMBL30934994 0.79 TGM2 (0.50) TGM2F13A1LMNATGM1TGM3
SCHEMBL1380051 0.79 TGM2 (1.00) TGM2F13A1LMNATGM1TGM3
SCHEMBL28741410 0.79 TGM2 (0.55) TGM2F13A1LMNATGM1TGM3

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-0409565-A1 Rubber composition useful for tires SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-23 EP disclosed