SCHEMBL22063687

SCHEMBL22063687

CCOc1cc(C2CCN(C(=O)CC)CC2)cc(OC)c1Cl

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 16/20 0.66
▸ ADAMTS5 Q9UNA0 10/20 0.51
▸ QDPR P09417 1/20 0.44

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
SCHEMBL22063174 0.88 ADAM17 (0.63) ADAM17ADAMTS5QDPR
SCHEMBL22063686 0.87 ADAM17 (0.64) ADAM17ADAMTS5QDPR
SCHEMBL22063189 0.87 ADAM17 (0.64) ADAM17ADAMTS5QDPR
SCHEMBL22063188 0.86 ADAMTS5 (0.64) ADAM17ADAMTS5QDPR
SCHEMBL19703139 0.84 ADAM17 (0.57) ADAM17ADAMTS5
SCHEMBL22063183 0.81 ADAM17 (0.61) ADAM17ADAMTS5QDPR
SCHEMBL22063780 0.81 ADAM17 (0.63) ADAM17ADAMTS5QDPR
SCHEMBL22063172 0.81 ADAM17 (0.62) ADAM17ADAMTS5QDPR
SCHEMBL22892289 0.81 ALK (0.48) ADAM17ADAMTS5
SCHEMBL19691677 0.80 ADAM17 (1.00) ADAM17ADAMTS5

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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