SCHEMBL7656290

SCHEMBL7656290

Cc1cc(COc2ccc(CC(=O)C3CCCN3C(=O)NO)cc2)c2ccccc2n1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 13/20 0.58

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
Trifluoroacetic Acid SCHEMBL7656192 0.95 ADAM17 (0.55) ADAM17
SCHEMBL7656200 0.88 ADAM17 (0.51) ADAM17
SCHEMBL6741074 0.84 ADAM17 (0.68) ADAM17
SCHEMBL6595238 0.82 ADAM17 (0.56) ADAM17
SCHEMBL7650602 0.81 ADAM17 (0.62) ADAM17
SCHEMBL6741443 0.81 ADAM17 (0.68) ADAM17
SCHEMBL6742035 0.81 ADAM17 (0.68) ADAM17
Trifluoroacetic Acid SCHEMBL6736529 0.80 ADAM17 (0.62) ADAM17
SCHEMBL8355674 0.79 ADAM17 (0.61) ADAM17
SCHEMBL8354913 0.79 ADAM17 (0.61) ADAM17

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-6376665-B1 ANTIARTHRITIC AGENTS, ANTIINFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-23 US claimed
US-6376665-B1 ANTIARTHRITIC AGENTS, ANTIINFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-23 US disclosed