SCHEMBL6843985

SCHEMBL6843985

NCCCNCCCCNCCCN(CCCCCNC(=O)OCc1ccccc1)CCCCCNC(=O)OCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.55
HTT P42858 1/20 0.54
KEAP1 Q14145 2/20 0.50
NFE2L2 Q16236 2/20 0.50
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CCR6 P51684 1/20 0.49
PAX8 Q06710 1/20 0.49
CPB1 P15086 1/20 0.47
CPB2 Q96IY4 1/20 0.47
DPP8 Q6V1X1 1/20 0.46
DPP7 Q9UHL4 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.46
SIRT1 Q96EB6 1/20 0.46
SIRT3 Q9NTG7 1/20 0.46

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
Hydrochloric Acid SCHEMBL5530644 0.99 TGM2 (0.54) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL16789587 0.90 HTT (0.62) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL22356684 0.90 HTT (0.65) TGM2HTTKEAP1NFE2L2LMNA
Hydrochloric Acid SCHEMBL8503422 0.89 TGM2 (0.61) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL27814052 0.89 HTT (0.63) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL6839361 0.88 TGM2 (0.62) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL23728768 0.88 HTT (0.65) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL22356685 0.88 HTT (0.65) TGM2HTTKEAP1NFE2L2LMNA
Hydrochloric Acid SCHEMBL5531602 0.87 TGM2 (0.61) TGM2HTTKEAP1NFE2L2LMNA
SCHEMBL30958383 0.86 LMNA (0.54) TGM2HTTKEAP1NFE2L2LMNA

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-0789708-B1 MULTIFUNCTIONAL MOLECULAR COMPLEXES FOR GENE TRANSFER TO CELLS WYETH CORP (US) 2004-11-03 EP claimed