SCHEMBL9865036

SCHEMBL9865036

C=CC(=O)Nc1ccc(Br)c(Br)c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 11/20 0.65
F13A1 P00488 1/20 0.65
LMNA P02545 1/20 0.65
TGM1 P22735 1/20 0.65
TGM3 Q08188 1/20 0.65
EGFR P00533 4/20 0.48
ERBB2 P04626 1/20 0.48
FYN P06241 1/20 0.48
SRC P12931 1/20 0.48
BTK Q06187 1/20 0.46
GSTO1 P78417 1/20 0.46
NOX1 Q9Y5S8 1/20 0.43

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
SCHEMBL22719741 0.84 TGM2 (0.59) TGM2F13A1LMNATGM1TGM3
SCHEMBL22719655 0.84 TGM2 (0.59) TGM2F13A1LMNATGM1TGM3
SCHEMBL9865437 0.80 TGM2 (0.58) TGM2F13A1LMNATGM1TGM3
SCHEMBL439369 0.80 TGM2 (0.79) TGM2F13A1LMNATGM1TGM3
SCHEMBL9864950 0.79 TGM2 (0.59) TGM2F13A1LMNATGM1TGM3
SCHEMBL29505040 0.79 TGM2 (0.59) TGM2F13A1LMNATGM1TGM3
SCHEMBL22719895 0.79 TGM2 (0.59) TGM2F13A1LMNATGM1TGM3
SCHEMBL1380051 0.79 TGM2 (1.00) TGM2F13A1LMNATGM1TGM3
SCHEMBL22461299 0.77 TGM2 (0.69) TGM2F13A1LMNATGM1TGM3
SCHEMBL1381249 0.76 TGM2 (1.00) 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