SCHEMBL6034845

SCHEMBL6034845

CN1CCN(S(=O)(=O)c2cc(F)c(Br)cc2F)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 3/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PKLR P30613 1/20 0.43
ENPP2 Q13822 1/20 0.43
POLB P06746 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
SCHEMBL3407041 0.94 L3MBTL1 (0.51) PKML3MBTL1ALDH1A1LMNAMAPT
SCHEMBL2508617 0.89 L3MBTL1 (0.53) PKML3MBTL1ALDH1A1LMNAMAPT
SCHEMBL6035836 0.88 L3MBTL1 (0.52) PKML3MBTL1ALDH1A1LMNAMAPT
SCHEMBL6034241 0.85 PKM (0.58) PKML3MBTL1ALDH1A1HTTPKLR
SCHEMBL6035064 0.84 PKM (0.56) PKML3MBTL1ALDH1A1MAPTHTT
SCHEMBL3345913 0.81 PKM (0.61) PKMALDH1A1LMNAKMT2AMEN1
SCHEMBL2933388 0.80 L3MBTL1 (0.50) L3MBTL1ALDH1A1LMNAMAPTHTT
SCHEMBL16064376 0.80 PKM (0.52) PKML3MBTL1ALDH1A1LMNAMAPT
SCHEMBL25941353 0.79 ALDH1A1 (0.65) PKML3MBTL1ALDH1A1MAPTPKLR
SCHEMBL5440864 0.77 TGM2 (0.57) PKMALDH1A1KMT2AMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060052396-A1 Arylamines for the treatment of conditions associated with gsk-3 ASTRAZENECA (SE) 2006-03-09 US claimed
EP-1414801-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 AstraZeneca AB (SE) 2004-05-06 EP claimed
WO-2003004472-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 ASTRAZENECA AB (SE) 2003-01-16 WO claimed
US-20060052396-A1 Arylamines for the treatment of conditions associated with gsk-3 ASTRAZENECA (SE) 2006-03-09 US disclosed
EP-1414801-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 AstraZeneca AB (SE) 2004-05-06 EP disclosed
WO-2003004472-A1 ARYLAMINES FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH GSK-3 ASTRAZENECA AB (SE) 2003-01-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060052396-A1 Arylamines for the treatment of conditions associated with gsk-3 GSK3A, GSK3B, PYGL PKM 121/4885L3MBTL1 2143/4885ALDH1A1 2625/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.