SCHEMBL23745287

SCHEMBL23745287

Cc1cc2c(cc1Cl)CN(C(=O)[C@H](C)C[C@@]1(C3CC3)NC(=O)NC1=O)C2

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 20/20 0.62
▸ MMP2 P08253 9/20 0.62
▸ MMP13 P45452 8/20 0.62
▸ ADAM17 P78536 5/20 0.62
▸ MMP14 P50281 3/20 0.55
▸ ADAMTS4 O75173 2/20 0.53
▸ CYP3A4 P08684 1/20 0.53

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
SCHEMBL29835194 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL29835188 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL29835128 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL23745288 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL23745219 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL23745217 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL23728083 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL23745284 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL29835176 0.94 ADAMTS5 (0.67) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL23745253 0.87 ADAMTS5 (0.59) ADAMTS5MMP2MMP13ADAM17MMP14

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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