SCHEMBL23745412

SCHEMBL23745412

O=C1NC(=O)[C@](CCC(=O)N2Cc3ccc(F)cc3C2)(C2CC2)N1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 20/20 0.65
▸ MMP2 P08253 5/20 0.65
▸ MMP13 P45452 2/20 0.60
▸ ADAMTS4 O75173 2/20 0.58
▸ MMP14 P50281 1/20 0.57
▸ ADAM17 P78536 1/20 0.56

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
SCHEMBL23745406 0.90 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4MMP14
SCHEMBL23745413 0.88 ADAMTS5 (0.69) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL31121194 0.88 ADAMTS5 (0.69) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL23745296 0.87 ADAMTS5 (0.68) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL29835195 0.87 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL23727712 0.87 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL23727713 0.87 ADAMTS5 (0.66) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL23745214 0.86 ADAMTS5 (0.55) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL29250237 0.86 ADAMTS5 (0.57) ADAMTS5MMP2MMP13ADAMTS4ADAM17
SCHEMBL29250236 0.86 ADAMTS5 (0.57) ADAMTS5MMP2MMP13ADAMTS4ADAM17

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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