SCHEMBL29567639

SCHEMBL29567639

CS(=O)(=O)CCC(c1ccc(-n2cc(-c3ccnc(N)c3N)cn2)nc1)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 2/20 0.32
▸ EGLN1 Q9GZT9 1/20 0.31
▸ GCG P01275 2/20 0.30
▸ GCGR P47871 1/20 0.30

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
SCHEMBL22736041 1.00 GRM4 (0.32) GRM4EGLN1GCGGCGR
SCHEMBL29480753 0.91 GCG (0.30) GRM4GCGGCGR
SCHEMBL22736330 0.91 GCG (0.30) GRM4GCGGCGR
SCHEMBL29480676 0.90 GCG (0.32) GRM4GCGGCGR
SCHEMBL22735964 0.89 GRM4 (0.32) GRM4
SCHEMBL22735968 0.88 — —
SCHEMBL29480751 0.88 — —
SCHEMBL22736542 0.86 GRM4 (0.33) GRM4
SCHEMBL22736320 0.84 GRM4 (0.32) GRM4EGLN1GCG
SCHEMBL29567465 0.84 GRM4 (0.32) GRM4EGLN1GCG

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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