SCHEMBL8522700

SCHEMBL8522700

CCCCCC(C(=O)c1cccs1)S(N)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.46
TSHR P16473 3/20 0.45
HTT P42858 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GLA P06280 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC3 O15379 1/20 0.44
HSPA5 P11021 2/20 0.43
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 1/20 0.42
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 3/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL20306087 0.79 HDAC1 (0.54) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL4324864 0.77 HDAC1 (0.52) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL22371932 0.77 CTSK (0.49) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL19185882 0.77 HDAC1 (0.52) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL5245406 0.76 CA2 (0.39) HDAC1CES2CES1CA2
SCHEMBL27984674 0.74 HDAC1 (0.49) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL5047571 0.73 TSHR (0.57) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL5179085 0.73 TSHR (0.53) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL13116466 0.72 TSHR (0.49) CTSKTSHRHTTL3MBTL1GLA
SCHEMBL5050004 0.71 TSHR (0.51) CTSKTSHRHTTL3MBTL1GLA

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
EP-0946552-A1 SULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1999-10-06 EP disclosed
WO-1998013366-A1 SULFONAMIDES AND DERIVATIVES THEREOF THAT MODULATE THE ACTIVITY OF ENDOTHELIN TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-04-02 WO disclosed