SCHEMBL6587912

SCHEMBL6587912

COC(C)c1nccc(N2CCN(S(=O)(=O)N(C)C)CC2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SORD Q00796 15/20 1.00
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SUV39H2 Q9H5I1 1/20 0.41
ALDH1A1 P00352 1/20 0.38
MCOLN3 Q8TDD5 1/20 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
SCHEMBL6585270 1.00 SORD (1.00) SORDKDM4EMEN1KMT2ASUV39H2
SCHEMBL6585040 0.86 SORD (0.76) SORDKDM4EMEN1KMT2AALDH1A1
SCHEMBL6586568 0.85 SORD (1.00) SORD
SCHEMBL6585366 0.85 SORD (1.00) SORD
SCHEMBL6585364 0.85 SORD (1.00) SORD
SCHEMBL6584718 0.82 SORD (0.69) SORD
SCHEMBL7588700 0.78 SORD (0.68) SORDKDM4EMEN1KMT2ASUV39H2
SCHEMBL9450503 0.77 SORD (0.74) SORDKDM4EMEN1KMT2ASUV39H2
Hydrochloric Acid SCHEMBL9450505 0.76 SORD (0.72) SORDKDM4EMEN1KMT2ASUV39H2
SCHEMBL6587390 0.75 SORD (0.64) SORDKDM4EMEN1KMT2ASUV39H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1041068-B1 Compounds for treating and preventing diabetic complications PFIZER PROD INC (US) 2004-04-14 EP disclosed
US-6294538-B1 ANTIDIABETIC AGENTS AND DIABETIC NEUROPATHY, TREATMENT WITH OXIDOREDUCTASE ENZYMES PFIZER INC. 2001-09-25 US disclosed
EP-1041068-A1 Compounds for treating and preventing diabetic complications Pfizer Products Inc. (US) 2000-10-04 EP disclosed