Sugi Predict

Sugi Predict / Compounds / SCHEMBL3860944

SCHEMBL3860944

SCHEMBL3860944

Cc1cc(COc2ccc(S(=O)(=O)N(C)[C@@H]3CCOC[C@H]3C(=O)NO)cc2)c2ccccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 18/20 1.00
▸ MMP13 P45452 1/20 0.60

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
SCHEMBL8270887 1.00 ADAM17 (1.00) ADAM17MMP13
SCHEMBL8270888 0.93 ADAM17 (1.00) ADAM17MMP13
SCHEMBL3860355 0.93 ADAM17 (1.00) ADAM17MMP13
SCHEMBL3860304 0.92 ADAM17 (0.85) ADAM17
SCHEMBL3863695 0.91 ADAM17 (0.84) ADAM17
SCHEMBL3861416 0.89 ADAM17 (1.00) ADAM17MMP13
SCHEMBL3859154 0.89 ADAM17 (1.00) ADAM17MMP13
SCHEMBL3861411 0.89 ADAM17 (1.00) ADAM17MMP13
SCHEMBL3859150 0.89 ADAM17 (1.00) ADAM17MMP13
SCHEMBL3859157 0.89 ADAM17 (1.00) ADAM17MMP13

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
US-7595327-B2 Exo-N-Hydroxy-3-[methyl({4-[(2-methylquinolin-4-yl) methoxy]phenyl}sulfonyl)amino]bicyclo[2.2.1]heptane-2-carboxamide; rheumatoid arthritis (RA), juvenile RA, psoriatic arthritis, ankylosing spondylitis, psoriasis, osteoarthritis, tumor metastasis, sepsis, AIDS, ulcerative colitis, multiple sclerosis WYETH (US) 2009-09-29 — — US claimed
US-7595327-B2 Exo-N-Hydroxy-3-[methyl({4-[(2-methylquinolin-4-yl) methoxy]phenyl}sulfonyl)amino]bicyclo[2.2.1]heptane-2-carboxamide; rheumatoid arthritis (RA), juvenile RA, psoriatic arthritis, ankylosing spondylitis, psoriasis, osteoarthritis, tumor metastasis, sepsis, AIDS, ulcerative colitis, multiple sclerosis WYETH (US) 2009-09-29 — — US disclosed