SCHEMBL6553206

SCHEMBL6553206

CCN(c1ccc(Cl)cc1[N+](=O)[O-])S(=O)(=O)c1cc(O)ccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
LMNA P02545 4/20 0.42
PSEN1 P49768 2/20 0.42
PSEN2 P49810 2/20 0.42
APH1B Q8WW43 2/20 0.42
NCSTN Q92542 2/20 0.42
APH1A Q96BI3 2/20 0.42
PSENEN Q9NZ42 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
CCR2 P41597 1/20 0.40
KIF18A Q8NI77 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
HTT P42858 1/20 0.39
VCAM1 P19320 2/20 0.39
APEX1 P27695 2/20 0.38
POLB P06746 2/20 0.38

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
SCHEMBL6555483 0.88 ALDH1A1 (0.50) ALDH1A1LMNAL3MBTL1SMN1; SMN2MAPT
SCHEMBL15638651 0.85 KIF18A (0.47) ALDH1A1LMNAPSEN1PSEN2APH1B
SCHEMBL6554749 0.80 PSEN1 (0.59) ALDH1A1LMNAPSEN1PSEN2APH1B
SCHEMBL69171 0.79 PSEN1 (0.61) ALDH1A1PSEN1PSEN2APH1BNCSTN
SCHEMBL29368302 0.79 PSEN1 (0.61) ALDH1A1PSEN1PSEN2APH1BNCSTN
SCHEMBL6555394 0.73 PSEN1 (0.48) ALDH1A1LMNAPSEN1PSEN2APH1B
Toluene SCHEMBL27750047 0.72 PSEN1 (0.50) ALDH1A1LMNAPSEN1PSEN2APH1B
SCHEMBL6553172 0.71 ALDH1A1 (0.51) ALDH1A1L3MBTL1SMN1; SMN2MAPK1TDP1
SCHEMBL6554646 0.70 ALDH1A1 (0.50) ALDH1A1LMNAL3MBTL1SMN1; SMN2MAPK1
SCHEMBL6554554 0.70 HSD11B1 (0.39) ALDH1A1PSEN1PSEN2APH1BNCSTN

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-1174028-B1 SULFONAMIDE DERIVATIVES SUMITOMO CHEM TAKEDA AGRO CO (JP) 2004-12-22 EP claimed