SCHEMBL6211

SCHEMBL6211

CS(=O)(=O)C(CCc1ccc(OCc2ccc(C(F)(F)F)cc2)cc1)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.57
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
ADAMTS4 O75173 1/20 0.48
MMP13 P45452 1/20 0.48
FFAR1 O14842 4/20 0.47
PPARG P37231 1/20 0.47
FFAR4 Q5NUL3 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
ADAM17 P78536 1/20 0.44
PPARA Q07869 1/20 0.43
NR4A2 P43354 1/20 0.43

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
SCHEMBL5810 0.89 MMP1 (0.48) MAOBMMP2MMP9FFAR1FFAR4
SCHEMBL5796 0.86 MAOB (0.46) MAOBADAMTS4MMP13FFAR1ADAM17
SCHEMBL6157 0.85 PARP10 (0.43) FFAR1
SCHEMBL5635 0.81 MMP2 (0.51) MAOBMMP2MMP9FFAR1FFAR4
SCHEMBL6072 0.78 LMNA (0.52) PPARGPPARA
SCHEMBL6213 0.78 MAOB (0.55) MAOBMMP2MMP9ADAMTS4MMP13
SCHEMBL11898792 0.78 ADAMTS4 (0.48) ADAMTS4MMP13
SCHEMBL11899992 0.77 PARP10 (0.48) FFAR1PPARGPPARA
SCHEMBL12048 0.77 ACACB (0.47) FFAR1PPARGPPARA
SCHEMBL6011 0.76 CA12 (0.46) MMP9MMP13ADAM17

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-2488489-A2 C-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS Pfizer Inc. (US) 2012-08-22 EP disclosed
WO-2011045703-A2 C-LINKED HYDROXAMIC ACID DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS PFIZER INC. (US) 2011-04-21 WO disclosed