SCHEMBL6951265

SCHEMBL6951265

N#CCCN(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)C(Cl)(Cl)C(=O)N2

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
LMNA P02545 3/20 0.47
GAA P10253 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
TP53 P04637 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
CNR2 P34972 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL6946269 0.80 PKLR (0.44) ALDH1A1LMNAGAAMAPTKMT2A
SCHEMBL7414364 0.73 PDE4A (0.70) LMNAMAPTPDE4APDE4BPDE4C
SCHEMBL6951305 0.70 MGAT2 (0.60) ALDH1A1LMNATP53
SCHEMBL6950459 0.67 KMT2A (0.48) ALDH1A1GAAMEN1KMT2ARXFP1
SCHEMBL7812463 0.67 MGAT2 (0.56) ALDH1A1LMNATP53
SCHEMBL11532888 0.67
SCHEMBL30555219 0.66 PKLR (0.55) ALDH1A1GAAHSD17B10TP53MEN1
SCHEMBL6954051 0.66 PKLR (0.55) ALDH1A1GAAHSD17B10TP53MEN1
SCHEMBL8307133 0.65 CASP3 (0.63) ALDH1A1LMNAGAAMAPT
SCHEMBL15682857 0.65 ALDH1A1 (0.69) ALDH1A1LMNAGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988035-B1 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORP (US) 2003-05-02 EP claimed
US-6214858-B1 PREVENTING AND TREATING EXCESSIVE CELL DEATH USING OXINDOLE DERIVATIVES SMITHKLINE BEECHAM CORPORATION 2001-04-10 US claimed
EP-0988035-B1 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORP (US) 2003-05-02 EP disclosed
US-6214858-B1 PREVENTING AND TREATING EXCESSIVE CELL DEATH USING OXINDOLE DERIVATIVES SMITHKLINE BEECHAM CORPORATION 2001-04-10 US disclosed