SCHEMBL6158

SCHEMBL6158

CS(=O)(=O)NC(=O)CCCc1ccc(OCc2ccc(S(C)(=O)=O)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
FFAR1 O14842 3/20 0.44
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
BMP1 P13497 1/20 0.43
MMP2 P08253 3/20 0.43
MMP9 P14780 3/20 0.43
MMP14 P50281 3/20 0.43
ADAM17 P78536 3/20 0.43
FFAR4 Q5NUL3 2/20 0.43
PSMB5 P28074 1/20 0.42
MMP1 P03956 2/20 0.42
NPC1 O15118 1/20 0.41
AR P10275 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ADAMTS4 O75173 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
SCHEMBL5797 0.87 EPHX2 (0.53) LTA4HFFAR1CYP4F2CYP4A11FFAR4
SCHEMBL5811 0.85 MMP2 (0.54) LTA4HFFAR1CYP4F2CYP4A11MMP2
SCHEMBL6212 0.85 MAOB (0.54) FFAR1MMP2MMP9FFAR4ADAMTS4
SCHEMBL6073 0.81 L3MBTL1 (0.56) LTA4HFFAR1CYP4F2CYP4A11MMP1
SCHEMBL11898793 0.81 CYP4F2 (0.51) LTA4HCYP4F2CYP4A11NPC1RAB9A
SCHEMBL11899994 0.80 LTA4H (0.61) LTA4HFFAR1
SCHEMBL5636 0.77 MMP2 (0.56) LTA4HFFAR1CYP4F2CYP4A11MMP2
SCHEMBL12049 0.77 LTA4H (0.50) LTA4HFFAR1CYP4F2CYP4A11SMN1; SMN2
SCHEMBL10689 0.76 CYSLTR1 (0.66) FFAR1
SCHEMBL6109 0.75 ADAM17 (0.54) LTA4HFFAR1CYP4F2CYP4A11MMP2

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