SCHEMBL8276342

SCHEMBL8276342

O=C(CBr)c1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.70
HDAC3 O15379 2/20 0.70
HDAC4 P56524 2/20 0.70
HDAC7 Q8WUI4 2/20 0.70
HDAC2 Q92769 2/20 0.70
HDAC10 Q969S8 2/20 0.70
HDAC11 Q96DB2 2/20 0.70
HDAC8 Q9BY41 2/20 0.70
HDAC6 Q9UBN7 2/20 0.70
HDAC9 Q9UKV0 2/20 0.70
HDAC5 Q9UQL6 2/20 0.70
ALDH1A1 P00352 3/20 0.70
LMNA P02545 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
GAA P10253 1/20 0.70
PLAU P00749 3/20 0.62
ATM Q13315 1/20 0.60
GPR27 Q9NS67 1/20 0.58
PGR P06401 1/20 0.58
PTPN1 P18031 1/20 0.57

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
SCHEMBL7782154 0.83 ALDH1A1 (0.77) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL27214027 0.83 CA12 (0.65) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL8277295 0.83 HDAC3 (1.00) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL8275407 0.82 ALDH1A1 (1.00) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL15480550 0.81 LMNA (0.73) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL5041234 0.80 HDAC1 (0.70) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL3563084 0.80 SLC16A3 (0.75) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL13987920 0.79 HDAC3 (0.93) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL808105 0.79 ATM (0.72) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL20021984 0.79 ATM (0.72) HDAC1ALDH1A1LMNASMN1; SMN2GAA

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
US-7470722-B2 Multicyclic sulfonamide compounds as inhibitors of histone deacetylase for the treatment of disease KALYPSYS, INC. (US) 2008-12-30 US disclosed
US-7470722-B2 Multicyclic sulfonamide compounds as inhibitors of histone deacetylase for the treatment of disease KALYPSYS, INC. (US) 2008-12-30 US disclosed
WO-2005123089-A2 MULTICYCLIC SULFONAMIDE COMPOUNDS AS INHIBITORS OF HISTONE DEACETYLASE FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2005-12-29 WO disclosed