SCHEMBL6813465

SCHEMBL6813465

CCOC(=O)CCN(C1(C(=O)OCc2ccccc2)CCCC1)S(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 3/20 0.55
SMN1; SMN2 Q16637 1/20 0.41
FFAR1 O14842 1/20 0.41
NR3C1 P04150 1/20 0.41
RORC P51449 1/20 0.40
CETP P11597 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LTA4H P09960 3/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.36
MMP13 P45452 2/20 0.36
HTT P42858 1/20 0.35

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
SCHEMBL6813135 0.90 MMP1 (0.67) MMP1FFAR1NR3C1RORCCETP
SCHEMBL6813259 0.89 MMP1 (0.59) MMP1SMN1; SMN2FFAR1NR3C1RORC
SCHEMBL6809653 0.88 MMP1 (0.62) MMP1SMN1; SMN2FFAR1NR3C1CETP
SCHEMBL6689521 0.87 MMP1 (0.61) MMP1SMN1; SMN2FFAR1NR3C1RORC
SCHEMBL6809611 0.86 MMP1 (0.54) MMP1SMN1; SMN2FFAR1NR3C1RORC
SCHEMBL6689128 0.86 MMP1 (0.65) MMP1SMN1; SMN2FFAR1NR3C1CETP
SCHEMBL4616532 0.85 MMP1 (0.49) MMP1RORCKMT2ATDP1
SCHEMBL6870847 0.85 MMP1 (0.55) MMP1SMN1; SMN2FFAR1CETPNPSR1
SCHEMBL6862342 0.85 MMP1 (0.59) MMP1SMN1; SMN2FFAR1CETPNPSR1
SCHEMBL6813091 0.83 MMP1 (0.76) MMP1SMN1; SMN2FFAR1CETPLTA4H

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 5 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
EP-1003720-A1 ARYLOXYARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES Pfizer Products Inc. (US) 2000-05-31 EP disclosed
WO-1999007675-A1 ARYLOXYARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER PRODUCTS INC. (US) 1999-02-18 WO disclosed