SCHEMBL8446552

SCHEMBL8446552

Cc1ccc(C#Cc2ccc(S(=O)(=O)N(CCOC(C)(C)C)[C@@H]([C]=O)C(=O)NO)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 13/20 0.42
MMP2 P08253 11/20 0.42
MMP13 P45452 11/20 0.42
MMP8 P22894 8/20 0.42
BMP1 P13497 3/20 0.37
MMP1 P03956 2/20 0.36
ADAM17 P78536 2/20 0.36
MMP3 P08254 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
SCHEMBL8446555 0.88 BMP1 (0.46) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8448761 0.86 MMP9 (0.46) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8445864 0.84 MMP9 (0.44) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8451051 0.83 POLB (0.41) MMP9MMP2MMP13MMP8MMP1
SCHEMBL8451686 0.83 MMP9 (0.45) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8450042 0.81 MMP9 (0.44) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8446283 0.80 MMP9 (0.47) MMP9MMP2MMP13MMP8MMP1
SCHEMBL8446566 0.79 MMP2 (0.51) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8448395 0.77 ALDH1A1 (0.43) MMP9MMP2MMP13MMP8BMP1
SCHEMBL8446550 0.74 MMP9 (0.55) MMP9MMP2MMP13MMP8MMP1

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-0915086-A1 PHENYLSULFONAMIDE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1999-05-12 EP claimed
EP-0915086-A1 PHENYLSULFONAMIDE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1999-05-12 EP disclosed