SCHEMBL29480665

SCHEMBL29480665

Nc1nccc(-c2cnn(-c3ccc(C(CCNC(=O)NC4CC4)C(F)(F)F)cn3)c2)c1[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 13/20 0.33
▸ GCG P01275 6/20 0.33
▸ GCGR P47871 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
SCHEMBL22716927 0.90 RIPK2 (0.33) RIPK2GCG
SCHEMBL29480738 0.90 RIPK2 (0.33) RIPK2GCG
SCHEMBL22736219 0.90 RIPK2 (0.36) RIPK2GCGGCGR
SCHEMBL29480743 0.90 RIPK2 (0.36) RIPK2GCGGCGR
SCHEMBL29480664 0.86 RIPK2 (0.34) RIPK2GCG
SCHEMBL22716891 0.86 RIPK2 (0.34) RIPK2GCG
SCHEMBL22735946 0.84 GRM4 (0.31) —
SCHEMBL29480659 0.84 GRM4 (0.31) —
SCHEMBL29480669 0.83 GRM4 (0.31) —
SCHEMBL29480723 0.82 — —

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 2 patents. 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
CN-114174294-A Novel compounds for inhibiting JANUS kinase 1 人类制药有限公司 2022-03-11 — — CN disclosed
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