SCHEMBL11834847

SCHEMBL11834847

CS(=O)(=O)C(CCC(=O)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
ADAMTS4 O75173 1/20 0.50
FFAR1 O14842 4/20 0.45
PTGS2 P35354 1/20 0.45
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HIF1A Q16665 1/20 0.44
MME P08473 1/20 0.43
MMP2 P08253 1/20 0.42
MMP7 P09237 1/20 0.42
MMP14 P50281 1/20 0.42

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
SCHEMBL10158 0.88 MMP9 (0.52) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL11831157 0.86 MMP9 (0.55) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL11829259 0.84 MMP9 (0.50) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL7345068 0.75 FFAR1 (0.52) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL11838193 0.73 FFAR1 (0.50) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL28710491 0.73 MMP9 (0.51) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL877721 0.73 FFAR1 (0.50) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL11828935 0.73 FFAR1 (0.50) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL11822261 0.73 FFAR1 (0.50) MMP9MMP8MMP13ADAMTS4FFAR1
SCHEMBL11823952 0.73 CHRNB2 (0.50) MMP9MMP8MMP13ADAMTS4FFAR1

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
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 US disclosed