SCHEMBL29567604

SCHEMBL29567604

N#CC(c1ccc(-n2cc(-c3ccnc(N)c3[N+](=O)[O-])cn2)nc1)N1CCS(=O)(=O)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RPS6KB1 P23443 2/20 0.32

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
SCHEMBL22736527 0.88 RPS6KB1 (0.33) RPS6KB1
SCHEMBL29567159 0.88 RPS6KB1 (0.33) RPS6KB1
SCHEMBL29567573 0.79 JAK2 (0.34) —
SCHEMBL22716894 0.79 JAK2 (0.34) —
SCHEMBL29480651 0.76 — —
SCHEMBL22736528 0.76 RPS6KB1 (0.34) RPS6KB1
SCHEMBL22735769 0.76 EGLN1 (0.33) —
SCHEMBL22736319 0.76 — —
SCHEMBL22735954 0.76 EGLN1 (0.34) —
SCHEMBL29480690 0.76 OGA (0.34) —

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-3976612-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD (IN) 2022-04-06 — — EP disclosed
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