SCHEMBL19709425

SCHEMBL19709425

COc1cncc(N2CCN(C(=O)[C@@H](C)C[C@@]3(C4CC4)NC(=O)NC3=O)C[C@@H]2C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 20/20 1.00
▸ MMP2 P08253 12/20 0.81
▸ MMP14 P50281 5/20 0.81
▸ MMP13 P45452 6/20 0.70
▸ ADAMTS4 O75173 2/20 0.70
▸ CYP3A4 P08684 1/20 0.70
▸ ADAM17 P78536 1/20 0.65

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
SCHEMBL19691502 1.00 ADAMTS5 (1.00) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL17871104 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL17884712 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL17871513 0.89 ADAMTS5 (1.00) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL22892307 0.88 ADAMTS5 (0.78) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL17871154 0.86 ADAMTS5 (1.00) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL19691565 0.85 ADAMTS5 (0.80) ADAMTS5MMP2ADAMTS4ADAM17
SCHEMBL22201098 0.83 ADAMTS5 (0.88) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL19759032 0.83 ADAMTS5 (0.88) ADAMTS5MMP2MMP14MMP13ADAMTS4
SCHEMBL20493620 0.82 ADAMTS5 (1.00) ADAMTS5MMP2MMP14MMP13ADAMTS4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3468955-B1 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) 2021-01-06 — — EP disclosed
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
WO-2017211666-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) 2017-12-14 — — WO 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 1/4885MMP2 35/4885MMP14 25/4885
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 1/4885MMP2 35/4885MMP14 25/4885

“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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