SCHEMBL22736310

SCHEMBL22736310

FC(F)(F)C(OCCNC1CC1)c1ccc(-n2cc(-c3ccnc4[nH]cnc34)cn2)nc1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 1/20 0.30
▸ JAK2 O60674 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
SCHEMBL29480490 1.00 GRM4 (0.30) GRM4JAK2
SCHEMBL29567531 0.89 GRM4 (0.32) GRM4JAK2
SCHEMBL22716906 0.89 GRM4 (0.32) GRM4JAK2
SCHEMBL22716870 0.87 JAK2 (0.31) GRM4JAK2
SCHEMBL29480640 0.87 JAK2 (0.31) GRM4JAK2
SCHEMBL22736243 0.85 JAK2 (0.34) GRM4JAK2
SCHEMBL29480731 0.85 JAK2 (0.31) GRM4JAK2
SCHEMBL22736493 0.85 JAK2 (0.31) GRM4JAK2
SCHEMBL29480616 0.85 JAK2 (0.34) GRM4JAK2
SCHEMBL22736184 0.83 GCG (0.33) —

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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