SCHEMBL9943583

SCHEMBL9943583

CCCC=CC(=O)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
MAOB P27338 1/20 0.55
PSMB11 A5LHX3 1/20 0.53
PSMA7 O14818 1/20 0.53
PSMB1 P20618 1/20 0.53
PSMA1 P25786 1/20 0.53
PSMA2 P25787 1/20 0.53
PSMA3 P25788 1/20 0.53
PSMA4 P25789 1/20 0.53
PSMB8 P28062 1/20 0.53
PSMB9 P28065 1/20 0.53
PSMA5 P28066 1/20 0.53
PSMB4 P28070 1/20 0.53
PSMB6 P28072 1/20 0.53
PSMB5 P28074 1/20 0.53
PSMB10 P40306 1/20 0.53
PSMB3 P49720 1/20 0.53
PSMB2 P49721 1/20 0.53

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
SCHEMBL4535391 0.83 TGM2 (0.54) TGM2MEN1KMT2AMAOBPSMB11
SCHEMBL16742068 0.80 TGM2 (0.65) TGM2MEN1KMT2AMAOBEPHX2
SCHEMBL8907266 0.80 PSMB11 (0.56) TGM2MEN1KMT2AMAOBPSMB11
SCHEMBL19280682 0.80 TGM2 (0.65) TGM2MEN1KMT2AMAOBEPHX2
SCHEMBL13174972 0.80 ALDH1A1 (0.68) TGM2MEN1KMT2AMAOBEPHX2
SCHEMBL13113128 0.78 TGM2 (0.63) TGM2MEN1KMT2AMAOBEPHX2
SCHEMBL15707930 0.78 TGM2 (0.55) TGM2MEN1KMT2AMAOBEPHX2
SCHEMBL15707928 0.78 TGM2 (0.55) TGM2MEN1KMT2AMAOBEPHX2
SCHEMBL9943778 0.78 CNR1 (0.80) TGM2MEN1KMT2APSMB11PSMA7
SCHEMBL13174657 0.75 ALDH1A1 (0.68) TGM2MAOBEPHX2CA12CA1

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-2464368-A1 CATHEPSIN C INHIBITORS Glaxo Group Limited (GB) 2012-06-20 EP disclosed