SCHEMBL21582799

SCHEMBL21582799

CC(C[C@@]1(C)NC(=O)NC1=O)C(=O)N1CCN(c2cc(F)c(Cl)c(F)c2)[C@@H](C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 20/20 1.00
▸ MMP2 P08253 9/20 1.00
▸ MMP14 P50281 8/20 1.00
▸ ADAMTS4 O75173 3/20 0.85
▸ ADAM17 P78536 1/20 0.84
▸ MMP13 P45452 2/20 0.79

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
SCHEMBL17871349 1.00 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL19691668 0.92 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL19709608 0.92 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871250 0.92 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871249 0.92 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871422 0.91 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871424 0.91 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871549 0.91 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871529 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17
SCHEMBL17871532 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP14ADAMTS4ADAM17

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
EP-3575294-A1 5-[(PIPERAZIN-1-YL)-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS Les Laboratoires Servier (FR) 2019-12-04 — — EP disclosed
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