SCHEMBL17871250

SCHEMBL17871250

CC(CC1(C)NC(=O)NC1=O)C(=O)N1CCN(c2cc(Cl)cc(Cl)c2)C(C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 19/20 1.00
▸ ADAM17 P78536 2/20 1.00
▸ MMP2 P08253 8/20 0.88
▸ MMP14 P50281 6/20 0.88
▸ MMP13 P45452 2/20 0.80
▸ ADAMTS4 O75173 2/20 0.75

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
SCHEMBL17871249 1.00 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871422 0.94 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871424 0.94 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871349 0.92 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL21582799 0.92 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871214 0.91 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871280 0.90 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871549 0.89 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL17871229 0.89 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13
SCHEMBL20694908 0.89 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP14MMP13

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237406-A1 5-[(PIPERAZIN-1-YL)-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS Galapagos NV (BE) 2017-11-01 — — EP disclosed
WO-2016102347-A1 5-[(PIPERAZIN-1-YL)-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS GALAPAGOS NV (BE) 2016-06-30 — — WO disclosed
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