SCHEMBL5810

SCHEMBL5810

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

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP14 P50281 1/20 0.48
ADAM17 P78536 1/20 0.48
EPHX1 P07099 2/20 0.45
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
MRGPRX4 Q96LA9 2/20 0.44
MAOB P27338 2/20 0.43
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
PTPRZ1 P23471 1/20 0.41
PARP10 Q53GL7 1/20 0.41

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
SCHEMBL5635 0.90 MMP2 (0.51) MMP2MMP9MMP14ADAM17FFAR1
SCHEMBL6211 0.89 MAOB (0.57) MMP2MMP9ADAM17FFAR1FFAR4
SCHEMBL6157 0.85 PARP10 (0.43) FFAR1PTPRZ1PARP10
SCHEMBL5796 0.84 MAOB (0.46) ADAM17FFAR1MAOBPARP10
SCHEMBL6072 0.78 LMNA (0.52)
SCHEMBL11898792 0.78 ADAMTS4 (0.48) CYP19A1CYP11B1CYP11B2
SCHEMBL5812 0.78 MMP1 (0.47) MMP1MMP2MMP9MMP14ADAM17
SCHEMBL11899992 0.77 PARP10 (0.48) FFAR1PARP10
SCHEMBL6011 0.76 CA12 (0.46) MMP1MMP9ADAM17CYP19A1
SCHEMBL12048 0.74 ACACB (0.47) FFAR1

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