SCHEMBL6825855

SCHEMBL6825855

Cc1ccc(S(=O)(=O)CCC2CCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
CYP3A4 P08684 2/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
TSHR P16473 1/20 0.46
KMT2A Q03164 6/20 0.46
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46
CRBN Q96SW2 1/20 0.46
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.44
ACHE P22303 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
PAX8 Q06710 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
SCHEMBL7459127 0.89 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL8555011 0.85 ALDH1A1 (0.51) ALDH1A1CYP3A4CYP2C9CYP2C19KMT2A
SCHEMBL6825585 0.84 CRBN (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL10228581 0.82 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL22337157 0.81 CTDSP1 (0.56) ALDH1A1TSHRKMT2AMEN1MAPK1
SCHEMBL21609725 0.81 CTDSP1 (0.56) ALDH1A1TSHRKMT2AMEN1MAPK1
SCHEMBL11774952 0.81 LMNA (0.47) ALDH1A1CYP3A4CYP2C9TSHRKMT2A
SCHEMBL6822328 0.80 CRBN (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL15616166 0.80 ALDH1A1 (0.53) ALDH1A1CYP3A4CYP2C9CYP2C19TSHR
SCHEMBL11775347 0.80 LMNA (0.50) ALDH1A1TSHRKMT2AMEN1MAPK1

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
WO-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed