SCHEMBL23745420

SCHEMBL23745420

O=C1NC(=O)[C@@H](CCC(=O)N2Cc3cccc(F)c3C2)N1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 16/20 0.56
▸ ADAMTS4 O75173 2/20 0.54
▸ ADAM17 P78536 3/20 0.47
▸ ADAM10 O14672 1/20 0.47
▸ MMP12 P39900 1/20 0.47
▸ ADAM9 Q13443 1/20 0.47
▸ DPP8 Q6V1X1 2/20 0.42
▸ DPP9 Q86TI2 2/20 0.42
▸ DPP7 Q9UHL4 2/20 0.42

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
SCHEMBL23745421 0.86 ADAMTS5 (0.66) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL23745408 0.83 ADAMTS5 (0.58) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL24187319 0.77 ADAMTS5 (0.55) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL30013015 0.75 ADAMTS5 (0.64) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL23745222 0.75 ADAMTS5 (0.53) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL23745344 0.74 ADAMTS5 (0.55) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL23745212 0.73 ADAMTS5 (0.52) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL23745411 0.72 ADAMTS5 (0.62) ADAMTS5ADAMTS4
SCHEMBL3478866 0.71 DPP8 (0.60) DPP8DPP9DPP7
SCHEMBL20708577 0.70 ADAMTS5 (0.78) ADAMTS5ADAMTS4ADAM17ADAM10MMP12

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
WO-2021158626-A1 ADAMTS INHIBITORS, PREPARATION METHODS AND MEDICINAL USES THEREOF Eternity Bioscience Inc. (US) 2021-08-12 — — WO disclosed
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