SCHEMBL29901800

SCHEMBL29901800

CCCCCCCCS(=O)(=O)Nc1cccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.55
PARP14 Q460N5 1/20 0.52
RECQL P46063 1/20 0.49
BRD4 O60885 1/20 0.48
BCHE P06276 1/20 0.48
KDM4E B2RXH2 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL10078555 1.00 KEAP1 (0.55) KEAP1PARP14RECQLBRD4BCHE
SCHEMBL24707507 0.85 KEAP1 (0.51) KEAP1PARP14RECQLBCHEKDM4E
SCHEMBL1978216 0.85 KDM4E (0.46) PARP14KDM4E
SCHEMBL11694405 0.84 TRPV1 (0.51) PARP14KMT2A
SCHEMBL2128507 0.82 KEAP1 (0.68) KEAP1PARP14RECQLBRD4BCHE
SCHEMBL7126486 0.81 ALDH1A1 (0.44) PARP14
SCHEMBL10886862 0.80 PGAM1 (0.51) PARP14
SCHEMBL17269669 0.80 KDM4E (0.50) PARP14KDM4E
SCHEMBL25989098 0.80 EP300 (0.58) KMT2A
SCHEMBL23014679 0.79 PARP14 (0.46) PARP14

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-3649107-B1 SULFONAMIDE MACROMOLECULES USEFUL AS SINGLE-ION CONDUCTING POLYMER ELECTROLYTE COMMISSARIAT ENERGIE ATOMIQUE (FR) 2022-10-12 EP disclosed