SCHEMBL6167147

SCHEMBL6167147

CC(c1ccccc1C(F)(F)F)N(O)C=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.43
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
HSD11B1 P28845 4/20 0.40
CNR2 P34972 2/20 0.39
P2RX7 Q99572 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CTSS P25774 1/20 0.37
NFKB1 P19838 1/20 0.37
ALDH1A1 P00352 1/20 0.35
MC4R P32245 1/20 0.35

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
SCHEMBL12296385 0.75 CRHBP (0.43) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL8427460 0.75 ACP3 (0.44) ACP3HSD11B1CNR2P2RX7SMN1; SMN2
SCHEMBL29580255 0.72 ACP3 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL2588201 0.72 P2RX7 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL2986939 0.72 ACP3 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL2224459 0.72 P2RX7 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL13168657 0.72 ACP3 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL1047625 0.72 P2RX7 (0.52) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL29907993 0.72 ACP3 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2
SCHEMBL343233 0.72 ACP3 (0.47) ACP3CRHBPCRHR2HSD11B1CNR2

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-1534281-A1 N-SULFONYLPIPERIDINES AS METALLOPROTEINASE INHIBITORS (TACE) Astrazeneca AB (SE) 2005-06-01 EP claimed
WO-2004006925-A1 N-SULFONYLPIPERIDINES AS METALLOPROTEINASE INHIBITORS (TACE) ASTRAZENECA AB (SE) 2004-01-22 WO claimed