SCHEMBL21582698

SCHEMBL21582698

Cn1ccc2ncc(N3CCNCC3)cc21

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 12/20 0.50
▸ CHRNA4 P43681 12/20 0.50
▸ MET P08581 4/20 0.50
▸ KDM4E B2RXH2 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
SCHEMBL17884663 0.79 ADAMTS5 (0.47) MET
SCHEMBL12004436 0.74 HTR3E (0.54) —
SCHEMBL30020071 0.71 CHRNB2 (0.89) CHRNB2CHRNA4KDM4E
SCHEMBL4355823 0.71 CHRNB2 (0.89) CHRNB2CHRNA4KDM4E
SCHEMBL12006727 0.71 HTR3E (0.54) —
SCHEMBL28244687 0.70 CHRNB2 (0.59) CHRNB2CHRNA4KDM4E
Hydrochloric Acid SCHEMBL4057198 0.70 CHRNB2 (0.86) CHRNB2CHRNA4KDM4E
SCHEMBL7924961 0.69 CYP1A2 (0.42) KDM4E
SCHEMBL9980467 0.68 CHRNB2 (0.53) CHRNB2CHRNA4KDM4E
SCHEMBL23346665 0.67 PIK3CB (0.49) MET

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-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
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