SCHEMBL7177694

SCHEMBL7177694

O=S(=O)(Nc1ccc(O)cc1)c1cccc(F)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.65
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
HDAC3 O15379 1/20 0.59
HDAC4 P56524 1/20 0.59
HDAC1 Q13547 1/20 0.59
HDAC7 Q8WUI4 1/20 0.59
HDAC2 Q92769 1/20 0.59
HDAC10 Q969S8 1/20 0.59
HDAC11 Q96DB2 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
HDAC9 Q9UKV0 1/20 0.59
HDAC5 Q9UQL6 1/20 0.59
KMT2A Q03164 2/20 0.58
DYRK1A Q13627 1/20 0.57
AURKA O14965 1/20 0.56
KDR P35968 1/20 0.56
AURKB Q96GD4 1/20 0.56
STAT3 P40763 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
SCHEMBL18995909 0.88 STAT3 (0.64) PGRLMNASMN1; SMN2KMT2ASTAT3
SCHEMBL7171908 0.86 PKM (0.62) PGRLMNASMN1; SMN2HDAC3HDAC4
SCHEMBL13807498 0.84 PGR (0.68) PGRLMNASMN1; SMN2HDAC3HDAC4
SCHEMBL29118882 0.84 PGR (0.65) PGRLMNASMN1; SMN2HDAC3HDAC4
SCHEMBL95797 0.84 PGR (0.65) PGRLMNASMN1; SMN2HDAC3HDAC4
SCHEMBL21086842 0.83 MAPT (0.60) PGRLMNASMN1; SMN2KMT2ASTAT3
SCHEMBL5326147 0.83 LMNA (0.65) PGRLMNASMN1; SMN2HDAC3HDAC4
SCHEMBL3484285 0.83 HDAC1 (0.55) LMNASMN1; SMN2HDAC3HDAC4HDAC1
SCHEMBL3484287 0.83 HDAC1 (0.55) LMNASMN1; SMN2HDAC3HDAC4HDAC1
SCHEMBL16719693 0.83 MAPT (0.61) PGRHDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579829-B2 Aromatic sulfonamide compound MITSUI CHEMICALS, INC. (JP) 2003-06-17 US disclosed
EP-1138517-A2 Developer composition and heat sensitive recording material Mitsui Chemicals, Inc. (JP) 2001-10-04 EP disclosed