SCHEMBL23745413

SCHEMBL23745413

O=C1NC(=O)[C@](CCC(=O)N2Cc3ccccc3C2)(C2CC2)N1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 19/20 0.69
▸ MMP2 P08253 4/20 0.61
▸ MMP13 P45452 2/20 0.60
▸ ADAMTS4 O75173 1/20 0.60
▸ ADAMTS1 Q9UHI8 1/20 0.60
▸ ADAM17 P78536 1/20 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
SCHEMBL31121194 1.00 ADAMTS5 (0.69) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL29262510 0.92 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL23745396 0.88 ADAMTS5 (0.72) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL29835195 0.88 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL23727712 0.88 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL23745412 0.88 ADAMTS5 (0.65) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL23727713 0.88 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL23745411 0.87 ADAMTS5 (0.62) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL23745407 0.87 MMP2 (0.57) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL23745410 0.87 MMP2 (0.65) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1

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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