SCHEMBL8719028

SCHEMBL8719028

O=S(=O)(c1cc[nH]c1S(=O)(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PTPRZ1 P23471 1/20 0.30

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
SCHEMBL8667881 0.73 KDM4E (0.35) ALDH1A1KDM4EHSD17B10
SCHEMBL8666593 0.71 NPC1 (0.35) ALDH1A1
SCHEMBL6628404 0.68 AHR (0.43) MAPK1
SCHEMBL8666789 0.68 IDO1 (0.42) ALDH1A1SMN1; SMN2MAPK1KDM4E
SCHEMBL6929900 0.67 CA2 (0.44) ALDH1A1SMN1; SMN2LMNAMAPK1HTT
SCHEMBL9249187 0.64 DAO (0.35) ALDH1A1SMN1; SMN2LMNAMAPK1HTT
SCHEMBL27495416 0.64 CA2 (0.42) ALDH1A1SMN1; SMN2LMNAHTTKDM4E
SCHEMBL2368227 0.64 EPAS1 (0.43) ALDH1A1
SCHEMBL10180608 0.62 HSD11B1 (0.49) ALDH1A1
SCHEMBL8054555 0.62 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2LMNAMAPK1HTT

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-0830709-A4 ELECTROLYTE MATERIALS CONTAINING HIGHLY DISSOCIATED METAL ION SALTS MOLTECH CORP (US) 1998-05-20 EP disclosed
EP-0830709-A1 ELECTROLYTE MATERIALS CONTAINING HIGHLY DISSOCIATED METAL ION SALTS Moltech Corporation (US) 1998-03-25 EP disclosed
WO-1996029753-A9 ELECTROLYTE MATERIALS CONTAINING HIGHLY DISSOCIATED METAL ION SALTS 1997-01-16 WO disclosed