SCHEMBL7319145

SCHEMBL7319145

CCc1c(N)c(C)c(S(=O)(=O)c2ccc(OC)cc2)c(C(=O)OC)c1Cc1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 9/20 0.47
MMP1 P03956 5/20 0.45
MMP13 P45452 5/20 0.45
MMP9 P14780 4/20 0.45
ADAM17 P78536 3/20 0.42
TP53 P04637 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL7311857 0.92 NAMPT (0.46) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7324058 0.92 NAMPT (0.49) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7322257 0.91 MMP13 (0.48) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7317439 0.90 MMP13 (0.49) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7320893 0.88 NAMPT (0.46) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7316608 0.86 MMP13 (0.47) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7320922 0.86 NAMPT (0.44) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7319935 0.85 NAMPT (0.48) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7321883 0.85 NAMPT (0.43) NAMPTMMP1MMP13MMP9ADAM17
SCHEMBL7317379 0.85 MMP13 (0.50) NAMPTMMP1MMP13MMP9ADAM17

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed