SCHEMBL9858481

SCHEMBL9858481

Cc1ccc(S(=O)(=O)C(CCCCOc2ccccc2)C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.53
MMP9 P14780 7/20 0.53
MMP3 P08254 1/20 0.53
MMP13 P45452 1/20 0.53
TDP1 Q9NUW8 2/20 0.46
POLB P06746 1/20 0.45
KMT2A Q03164 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
TP53 P04637 1/20 0.44
GRM2 Q14416 1/20 0.43
MEN1 O00255 1/20 0.43
DRD2 P14416 2/20 0.43
DRD4 P21917 2/20 0.43
DRD3 P35462 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 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
SCHEMBL9613916 0.99 MMP9 (0.52) MMP2MMP9MMP3MMP13TDP1
SCHEMBL9614130 0.94 MMP9 (0.48) MMP2MMP9MMP3MMP13POLB
SCHEMBL10419451 0.89 MMP2 (0.55) MMP2MMP9MMP3MMP13POLB
SCHEMBL9858467 0.89 MMP9 (0.55) MMP2MMP9MMP3MMP13KMT2A
SCHEMBL9614153 0.88 MMP9 (0.46) MMP2MMP9MMP3MMP13POLB
SCHEMBL10419485 0.88 MMP9 (0.54) MMP2MMP9MMP3MMP13KMT2A
SCHEMBL9614020 0.88 MMP2 (0.51) MMP2MMP9MMP3MMP13TDP1
SCHEMBL9613940 0.84 MMP9 (0.49) MMP2MMP9MMP3MMP13KMT2A
SCHEMBL9614084 0.84 PPARG (0.48) MMP2MMP9KMT2AMEN1ALDH1A1
SCHEMBL9613976 0.82 MMP2 (0.51) MMP2MMP9MMP3MMP13TDP1

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-0279162-B1 CARBONIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICALS CONTAINING THEM Roche Diagnostics GmbH (DE) 1991-06-19 EP disclosed
EP-0279162-A1 Carbonic acid derivatives, process for their preparation and pharmaceuticals containing them Roche Diagnostics GmbH (DE) 1988-08-24 EP disclosed