SCHEMBL7873725

SCHEMBL7873725

O=S(=O)(c1ccc(S(=O)(=O)C(F)(F)F)[nH]1)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
LMNA P02545 2/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KIF11 P52732 2/20 0.35
PTPRZ1 P23471 1/20 0.34
ESPL1 Q14674 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA13 Q8N1Q1 1/20 0.30
POLB P06746 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
SCHEMBL9254319 0.75 GCGR (0.43) ALDH1A1LMNAHTTKIF11POLB
SCHEMBL9249187 0.72 DAO (0.35) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7874064 0.66 ALDH1A1 (0.41) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL6929900 0.65 CA2 (0.44) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL777153 0.63 HTR6 (0.50) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL1334378 0.63 ALDH1A1 (0.54) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL9427880 0.62 ALDH1A1 (0.42) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL999350 0.62 GAA (0.58) ALDH1A1LMNASMN1; SMN2CA1CA2
SCHEMBL8519013 0.62 ALDH1A1 (0.57) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7937243 0.62 ALDH1A1 (0.52) ALDH1A1LMNAMAPK1HTTSMN1; SMN2

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-0830709-B1 ELECTROLYTE MATERIALS CONTAINING HIGHLY DISSOCIATED METAL ION SALTS MOLTECH CORP (US) 2001-07-04 EP disclosed
WO-1996029753-A9 ELECTROLYTE MATERIALS CONTAINING HIGHLY DISSOCIATED METAL ION SALTS 1997-01-16 WO disclosed
WO-1996029753-A1 ELECTROLYTE MATERIALS CONTAINING HIGHLY DISSOCIATED METAL ION SALTS MOLTECH CORPORATION (US) 1996-09-26 WO disclosed
US-5538812-A ELECTROLYTIC CELLS WITH POLYETHERSILOXANES WITH GROUPS OF TRIFLUOROMETHANESULFONYL MOLTECH CORPORATION (US) 1996-07-23 US disclosed