SCHEMBL22736527

SCHEMBL22736527

N#CC(c1ccc(-n2cc(-c3ccnc(N)c3N)cn2)nc1)N1CCS(=O)(=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RPS6KB1 P23443 5/20 0.33
▸ GRM4 Q14833 1/20 0.31

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
SCHEMBL29567159 1.00 RPS6KB1 (0.33) RPS6KB1GRM4
SCHEMBL29567604 0.88 RPS6KB1 (0.32) RPS6KB1
SCHEMBL22736528 0.86 RPS6KB1 (0.34) RPS6KB1GRM4
SCHEMBL22716894 0.83 JAK2 (0.34) GRM4
SCHEMBL29567573 0.83 JAK2 (0.34) GRM4
SCHEMBL22736320 0.74 GRM4 (0.32) GRM4
SCHEMBL29567465 0.74 GRM4 (0.32) GRM4
SCHEMBL29567290 0.73 EGLN1 (0.38) GRM4
SCHEMBL22736535 0.72 EGLN1 (0.42) GRM4
SCHEMBL29480770 0.72 EGLN1 (0.42) GRM4

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
WO-2020240586-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2020-12-03 — — WO disclosed
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