SCHEMBL20184434

SCHEMBL20184434

Nc1cc(-c2ncnc3[nH]cc(C(=O)O)c23)ccc1CO

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 20/20 0.74
JAK2 O60674 19/20 0.74

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
SCHEMBL20184564 0.87 JAK3 (0.63) JAK3JAK2
SCHEMBL15013923 0.85 JAK3 (1.00) JAK3JAK2
SCHEMBL20184409 0.83 JAK3 (0.55) JAK3JAK2
SCHEMBL20184362 0.83 JAK3 (0.74) JAK3JAK2
SCHEMBL20184596 0.83 JAK3 (0.71) JAK3JAK2
SCHEMBL20184515 0.81 JAK3 (0.56) JAK3JAK2
SCHEMBL20184379 0.81 JAK3 (0.78) JAK3JAK2
SCHEMBL15013990 0.81 JAK3 (0.50) JAK3JAK2
SCHEMBL20184346 0.80 JAK2 (0.67) JAK3JAK2
SCHEMBL20184531 0.78 JAK3 (0.56) JAK3JAK2

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-2788000-B1 PYRROLOPYRIMIDINES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2018-05-30 EP claimed