SCHEMBL21048464

SCHEMBL21048464

O=S(=O)(NCCCCCCCCCCNS(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 1.00
PKM P14618 3/20 1.00
KDM4E B2RXH2 1/20 1.00
LMNA P02545 1/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
TBXA2R P21731 2/20 0.77
MAPK1 P28482 1/20 0.68
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
TSHR P16473 1/20 0.62
KEAP1 Q14145 1/20 0.59
HDAC3 O15379 1/20 0.57
HDAC1 Q13547 1/20 0.57
TP53 P04637 1/20 0.57
GAA P10253 1/20 0.57
EPHX2 P34913 1/20 0.56

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
SCHEMBL8349699 1.00 ALDH1A1 (1.00) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL12672471 1.00 ALDH1A1 (1.00) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL9577143 1.00 ALDH1A1 (1.00) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL10453840 0.98 ALDH1A1 (0.96) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL5020960 0.91 ALDH1A1 (0.82) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL578832 0.91 ALDH1A1 (0.82) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL1279062 0.91 ALDH1A1 (0.82) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL633906 0.91 ALDH1A1 (0.82) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL11623917 0.91 ALDH1A1 (0.82) ALDH1A1PKMKDM4ELMNASMN1; SMN2
SCHEMBL11649813 0.91 ALDH1A1 (0.82) ALDH1A1PKMKDM4ELMNASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2417198-B1 POLYAMIDE MATERIAL HAVING HIGH FLUID BARRIER PROPERTIES RHODIA OPERATIONS (FR) 2019-06-12 EP claimed