SCHEMBL21473385

SCHEMBL21473385

COc1cc(N2CCN(C(=O)CCC3CC(=O)NC(=O)N3)C[C@@H]2C)ccc1Cl

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 17/20 0.66
▸ ADAMTS4 O75173 4/20 0.53
▸ MMP2 P08253 5/20 0.52
▸ MMP14 P50281 3/20 0.52
▸ CCR1 P32246 2/20 0.51

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
SCHEMBL19691584 0.87 ADAMTS5 (0.79) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL21473409 0.80 ADAMTS5 (0.77) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL19691604 0.79 ADAMTS5 (1.00) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL19691614 0.79 ADAMTS5 (1.00) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL19691557 0.79 ADAMTS5 (1.00) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL19691524 0.77 ADAMTS5 (0.90) ADAMTS5ADAMTS4
SCHEMBL19691477 0.75 ADAMTS5 (1.00) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL22892241 0.75 ADAMTS5 (0.77) ADAMTS5ADAMTS4MMP2MMP14
SCHEMBL19691554 0.74 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL19691708 0.73 ADAMTS5 (0.81) ADAMTS5ADAMTS4

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
US-10829478-B2 5-[3-[piperazin-1-yl]-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS 4 and 5 inhibitors for treating e.g. osteoarthritis GALAPAGOS NV (BE) 2020-11-10 — — US disclosed
US-20190315719-A1 5-[3-[PIPERAZIN-1-YL]-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS 4 AND 5 INHIBITORS FOR TREATING E.G. OSTEOARTHRITIS GALAPAGOS NV (BE) 2019-10-17 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190315719-A1 5-[3-[PIPERAZIN-1-YL]-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS 4 AND 5 INHIBITORS FOR TREATING E.G. OSTEOARTHRITIS ADAMTS5, ADAMTS4, ADAMTS1 ADAMTS5 1/4885ADAMTS4 2/4885MMP2 35/4885
US-10829478-B2 5-[3-[piperazin-1-yl]-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS 4 and 5 inhibitors for treating e.g. osteoarthritis ADAMTS5, ADAMTS4, ADAMTS1 ADAMTS5 1/4885ADAMTS4 2/4885MMP2 35/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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