SCHEMBL5811

SCHEMBL5811

CS(=O)(=O)NC(=O)CCCc1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.54
MMP9 P14780 2/20 0.54
MMP14 P50281 2/20 0.54
ADAM17 P78536 2/20 0.54
MMP1 P03956 1/20 0.54
MRGPRX4 Q96LA9 2/20 0.46
FFAR1 O14842 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44
LTA4H P09960 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
MMP3 P08254 1/20 0.41
MMP10 P09238 1/20 0.41
KCNH2 Q12809 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
SCHEMBL5636 0.90 MMP2 (0.56) MMP2MMP9MMP14ADAM17MMP1
SCHEMBL6212 0.89 MAOB (0.54) MMP2MMP9FFAR1FFAR4MEN1
SCHEMBL6158 0.85 LTA4H (0.46) MMP2MMP9MMP14ADAM17MMP1
SCHEMBL5797 0.84 EPHX2 (0.53) FFAR1FFAR4LTA4HCYP4F2CYP4A11
SCHEMBL366570 0.81 MMP1 (0.58) MMP2MMP9MMP14ADAM17MMP1
SCHEMBL6073 0.78 L3MBTL1 (0.56) MMP1FFAR1LTA4HMEN1KMT2A
SCHEMBL11898793 0.78 CYP4F2 (0.51) LTA4HMEN1KMT2ASMN1; SMN2CYP4F2
SCHEMBL11899994 0.77 LTA4H (0.61) FFAR1LTA4H
SCHEMBL1744720 0.74 FFAR1 (0.53) MMP2MMP9MMP14ADAM17MMP1
SCHEMBL10689 0.73 CYSLTR1 (0.66) 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