SCHEMBL4730240

SCHEMBL4730240

Cc1cc2c(cc1S(=O)(=O)NC1CCN(C(=O)O)CC1)S(O)(O)c1ccccc1C2(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 16/20 0.39
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
WNT3 P56703 1/20 0.37
SFRP1 Q8N474 1/20 0.37

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
SCHEMBL4730237 0.91 MEN1 (0.39) CCR8CYP3A4CYP2C19MEN1KMT2A
SCHEMBL4784267 0.90 SFRP1 (0.48) CCR8WNT3SFRP1
SCHEMBL4733197 0.88 CCR8 (0.43) CCR8MEN1KMT2A
SCHEMBL4730986 0.88 SFRP1 (0.46) CCR8CYP3A4CYP2C19MEN1KMT2A
SCHEMBL4735363 0.88 CCR8 (0.39) CCR8MEN1KMT2ASFRP1
SCHEMBL4733261 0.85 SFRP1 (0.51) MEN1KMT2ASFRP1
SCHEMBL4731311 0.81 SFRP1 (0.48) CCR8WNT3SFRP1
SCHEMBL4733321 0.80 CCR8 (0.47) CCR8CYP3A4CYP2C19WNT3SFRP1
SCHEMBL4732159 0.80 SFRP1 (0.49) CCR8SFRP1
SCHEMBL4733195 0.79 CCR8 (0.41) CCR8MEN1KMT2A

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-2008061029-A1 ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO disclosed