SCHEMBL21870793

SCHEMBL21870793

CSc1cccc(Nc2ncc(F)c(-c3c[nH]c4c(Cl)nccc34)n2)c1F

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 19/20 0.44
▸ JAK2 O60674 15/20 0.44
▸ TYK2 P29597 1/20 0.41

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
SCHEMBL21870794 0.85 JAK1 (0.61) JAK1JAK2TYK2
SCHEMBL21870763 0.81 JAK2 (0.45) JAK1JAK2
SCHEMBL23678674 0.77 JAK2 (0.51) JAK1JAK2
SCHEMBL23678811 0.77 AURKA (0.42) JAK2TYK2
SCHEMBL21870698 0.77 JAK2 (0.61) JAK1JAK2
SCHEMBL21870699 0.77 JAK2 (0.44) JAK1JAK2
SCHEMBL23678568 0.75 JAK1 (0.70) JAK1JAK2TYK2
SCHEMBL21870805 0.74 JAK2 (0.52) JAK1JAK2
SCHEMBL23678608 0.72 JAK2 (0.48) JAK1JAK2
SCHEMBL25959622 0.71 JAK1 (0.81) JAK1JAK2TYK2

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-3854793-A1 AROMATIC HETEROCYCLIC COMPOUND WITH KINASE INHIBITORY ACTIVITY Shanghai Ennovabio Pharmaceuticals Co., Ltd. (CN) 2021-07-28 — — EP disclosed
WO-2020057669-A1 AROMATIC HETEROCYCLIC COMPOUND WITH KINASE INHIBITORY ACTIVITY 上海轶诺药业有限公司 2020-03-26 — — WO disclosed
Send feedback