SCHEMBL7316266

SCHEMBL7316266

COc1ccc(S(=O)(=O)c2ccc(C(=O)O)c(Cc3ccccc3)c2N)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.52
MMP12 P39900 11/20 0.52
MMP13 P45452 11/20 0.52
MMP8 P22894 10/20 0.52
MMP14 P50281 10/20 0.52
MMP16 P51512 10/20 0.52
MMP9 P14780 11/20 0.49
MMP3 P08254 7/20 0.49
MMP1 P03956 6/20 0.49
ADAM17 P78536 1/20 0.49
CNR1 P21554 2/20 0.46
PTGES O14684 1/20 0.43
TAS2R14 Q9NYV8 1/20 0.43
TAS2R8 Q9NYW2 1/20 0.43
CXCR3 P49682 1/20 0.43
ALDH1A1 P00352 2/20 0.42
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
LTA4H P09960 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
SCHEMBL7318272 0.89 MMP13 (0.60) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7318564 0.86 MMP2 (0.49) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7317813 0.84 MMP2 (0.49) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7313468 0.84 MMP2 (0.49) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7351236 0.83 MMP2 (0.48) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7321858 0.81 RAPGEF4 (0.47) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7325283 0.81 MMP2 (0.49) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7325058 0.81 MMP13 (0.47) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7315547 0.80 MMP13 (0.46) MMP2MMP12MMP13MMP8MMP14
SCHEMBL7322110 0.80 MMP2 (0.46) MMP2MMP12MMP13MMP8MMP14

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