SCHEMBL20708598

SCHEMBL20708598

O=C1NC(=O)C(CCC(=O)N2CCN(c3ccc(Cl)c(F)c3)CC2)(c2cccnc2)N1

nearest known ligand 0.87

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 20/20 0.87
▸ MMP2 P08253 7/20 0.87
▸ MMP13 P45452 5/20 0.87
▸ ADAM17 P78536 8/20 0.80
▸ ADAMTS4 O75173 1/20 0.69
▸ MMP14 P50281 1/20 0.69

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
SCHEMBL17871151 0.93 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL17871153 0.92 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL17871285 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17
SCHEMBL17871342 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL17871335 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL17871353 0.87 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17MMP14
SCHEMBL20708255 0.87 ADAMTS5 (0.90) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL17871295 0.87 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL20708446 0.87 ADAMTS5 (0.86) ADAMTS5MMP2MMP13ADAM17ADAMTS4
SCHEMBL19759023 0.86 ADAMTS5 (0.75) 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 2 patents. 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
EP-3237406-B1 5-[(PIPERAZIN-1-YL)-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS GALAPAGOS NV (BE) 2019-02-06 — — EP disclosed
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