SCHEMBL22062950

SCHEMBL22062950

O=C1NC(=O)C(CCC(=O)N2CCCCC2)(C2CC2)N1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 19/20 0.67
▸ ADAM17 P78536 3/20 0.66
▸ MMP2 P08253 4/20 0.65
▸ MMP13 P45452 2/20 0.61
▸ ADAMTS4 O75173 1/20 0.61
▸ ADAMTS1 Q9UHI8 1/20 0.61

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
SCHEMBL20708173 0.88 ADAMTS5 (0.63) ADAMTS5ADAM17MMP2MMP13ADAMTS4
SCHEMBL23745396 0.83 ADAMTS5 (0.72) ADAMTS5ADAM17MMP2MMP13ADAMTS4
SCHEMBL17871521 0.81 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP13ADAMTS4
SCHEMBL19691673 0.81 ADAMTS5 (1.00) ADAMTS5MMP2MMP13ADAMTS4ADAMTS1
SCHEMBL17871227 0.80 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP13ADAMTS4
SCHEMBL17871350 0.80 ADAMTS5 (1.00) ADAMTS5ADAM17MMP2MMP13ADAMTS4
SCHEMBL17884739 0.80 ADAMTS5 (0.64) ADAMTS5ADAM17MMP2ADAMTS4
SCHEMBL17884738 0.80 ADAMTS5 (0.64) ADAMTS5ADAM17MMP2ADAMTS4
SCHEMBL31121194 0.80 ADAMTS5 (0.69) ADAMTS5ADAM17MMP2MMP13ADAMTS4
SCHEMBL23745413 0.80 ADAMTS5 (0.69) ADAMTS5ADAM17MMP2MMP13ADAMTS4

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-3468961-B1 5-[3-[PIPERIDIN-1-YL]-3-OXO-PROPYL]-IMIDAZOLIDINE-2,4-DIONE DERIVATIVES AS ADAMTS 4 AND 5 INHIBITORS FOR TREATING E.G. OSTEOARTHRITIS GALAPAGOS NV (BE) 2020-06-10 — — EP disclosed
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