SCHEMBL7317543

SCHEMBL7317543

CC#CCOc1ccc(S(=O)(=O)C(C(=O)NO)C2CCNC(Cc3ccc(OC)cc3)C2)cc1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 20/20 0.68
MMP13 P45452 10/20 0.63
MMP9 P14780 8/20 0.60
MMP1 P03956 5/20 0.49

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
SCHEMBL3938344 0.82 ADAM17 (1.00) ADAM17MMP13MMP9MMP1
SCHEMBL6656433 0.80 ADAM17 (0.73) ADAM17MMP13MMP9MMP1
SCHEMBL6659884 0.78 ADAM17 (1.00) ADAM17MMP13MMP9MMP1
SCHEMBL3947817 0.76 ADAM17 (1.00) ADAM17MMP13MMP9MMP1
SCHEMBL3949526 0.76 ADAM17 (1.00) ADAM17MMP13MMP9MMP1
SCHEMBL7422448 0.76 ADAM17 (0.78) ADAM17MMP13MMP9MMP1
SCHEMBL6654744 0.75 ADAM17 (0.80) ADAM17MMP13MMP9MMP1
SCHEMBL6657039 0.75 ADAM17 (0.80) ADAM17MMP13MMP9MMP1
SCHEMBL3941409 0.75 ADAM17 (0.80) ADAM17MMP13MMP9MMP1
SCHEMBL3940267 0.75 ADAM17 (1.00) ADAM17MMP13MMP9MMP1

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-6340691-B1 TREATMENT OF ARTHRITIS, TUMOR METASTASIS, TISSUE ULCERATION, ABNORMAL WOUND HEALING, PERIODONTAL DISEASE, BONE DISEASE, DIABETES (INSULIN RESISTANCE) AND HIV INFECTION AMERICAN CYANAMID COMPANY 2002-01-22 US disclosed