SCHEMBL5635

SCHEMBL5635

CS(=O)(=O)C(CCc1ccc(OCc2cccc(OC(F)(F)F)c2)cc1)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP14 P50281 1/20 0.51
ADAM17 P78536 1/20 0.51
MRGPRX4 Q96LA9 2/20 0.49
CYP19A1 P11511 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
FFAR1 O14842 4/20 0.44
MAOB P27338 5/20 0.44
FFAR4 Q5NUL3 2/20 0.43
MAOA P21397 1/20 0.43
SCN9A Q15858 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 0.90 MMP1 (0.48) MMP2MMP9MMP14ADAM17MRGPRX4
SCHEMBL6211 0.81 MAOB (0.57) MMP2MMP9ADAM17FFAR1MAOB
SCHEMBL5637 0.79 MMP2 (0.50) MMP2MMP9MMP14ADAM17MRGPRX4
SCHEMBL6157 0.77 PARP10 (0.43) FFAR1
SCHEMBL11898792 0.77 ADAMTS4 (0.48) CYP19A1CYP11B1CYP11B2
SCHEMBL11899992 0.77 PARP10 (0.48) FFAR1
SCHEMBL5796 0.76 MAOB (0.46) ADAM17FFAR1MAOB
SCHEMBL5636 0.76 MMP2 (0.56) MMP2MMP9MMP14ADAM17MRGPRX4
SCHEMBL15936282 0.76 MRGPRX4 (0.57) MMP2MMP9MMP14ADAM17MRGPRX4
SCHEMBL13462733 0.74 MRGPRX4 (0.58) MMP2MMP9MMP14ADAM17MRGPRX4

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