SCHEMBL9614049

SCHEMBL9614049

Cc1ccc(S(=O)(=O)C(COCCc2ccc(Cl)cc2)C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.49
MMP9 P14780 4/20 0.49
CNR2 P34972 1/20 0.45
KMT2A Q03164 2/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
ALDH1A1 P00352 3/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.42
LMNA P02545 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
FKBP1A P62942 1/20 0.41
HTT P42858 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL9613999 0.93 FKBP1A (0.48) MMP2MMP9CNR2KMT2APPARG
SCHEMBL9614319 0.89 MMP2 (0.54) MMP2MMP9CNR2KMT2APPARG
SCHEMBL9614069 0.89 MMP9 (0.47) MMP2MMP9CNR2KMT2AALDH1A1
SCHEMBL9614324 0.82 MMP2 (0.46) MMP2MMP9CNR2ALDH1A1LMNA
SCHEMBL10419216 0.81 MMP2 (0.59) MMP2MMP9CNR2KMT2APPARG
SCHEMBL10419184 0.81 MMP2 (0.57) MMP2MMP9CNR2KMT2APPARG
SCHEMBL9858523 0.81 MMP2 (0.44) MMP2MMP9CNR2KMT2AEGFR
SCHEMBL10420484 0.80 MMP2 (0.56) MMP2MMP9CNR2KMT2APPARG
SCHEMBL865930 0.80 MMP2 (0.56) MMP2MMP9CNR2KMT2APPARG
SCHEMBL10419952 0.80 MMP2 (0.56) MMP2MMP9CNR2KMT2APPARG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145611-A Diabetes BOEHRINGER MANNHEIM GMBH (DE) 1992-09-08 US disclosed
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