SCHEMBL6813259

SCHEMBL6813259

CCOC(=O)CCN(C1(C(=O)NOCc2ccccc2)CCCC1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.59
CETP P11597 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
LTA4H P09960 3/20 0.39
FFAR1 O14842 1/20 0.39
NR3C1 P04150 1/20 0.38
RORC P51449 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MMP13 P45452 5/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL6689521 0.98 MMP1 (0.61) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL6813465 0.89 MMP1 (0.55) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL4614179 0.86 MMP1 (0.51) MMP1RORCNPSR1KMT2AALDH1A1
SCHEMBL6813091 0.86 MMP1 (0.76) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL6809653 0.85 MMP1 (0.62) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL6691684 0.84 MMP1 (0.79) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL6689128 0.83 MMP1 (0.65) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL6862342 0.82 MMP1 (0.59) MMP1CETPSMN1; SMN2LTA4HFFAR1
SCHEMBL6693057 0.81 MMP1 (0.68) MMP1LTA4HMMP13
SCHEMBL6813135 0.81 MMP1 (0.67) MMP1CETPLTA4HFFAR1NR3C1

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
EP-1415984-A1 Aryloxyarylsulfonylamino hydroxamic acid derivatives Pfizer Products Inc. (US) 2004-05-06 EP disclosed
EP-1003720-B1 ARYLOXYARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER PROD INC (US) 2004-03-31 EP disclosed
US-6214872-B1 ANTIARTHRITIC AND ANTICARCINOGENIC AGENTS PFIZER INC. 2001-04-10 US disclosed