SCHEMBL30356129

SCHEMBL30356129

N#CCCCS(=O)(=O)Nc1ccc(-c2nc(NC(=O)C3CC3)nc3[nH]cnc23)cc1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 20/20 0.75

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
SCHEMBL20917996 1.00 JAK1 (0.75) JAK1
SCHEMBL20918692 0.87 JAK1 (0.76) JAK1
SCHEMBL20918015 0.86 JAK1 (0.71) JAK1
SCHEMBL30356056 0.86 JAK1 (0.71) JAK1
SCHEMBL20930544 0.86 JAK1 (1.00) JAK1
SCHEMBL20930234 0.84 JAK1 (0.54) JAK1
SCHEMBL30356216 0.77 JAK1 (0.74) JAK1
SCHEMBL20918119 0.77 JAK1 (0.74) JAK1
SCHEMBL30009783 0.76 KIT (0.47) JAK1
SCHEMBL20917871 0.76 JAK1 (0.60) JAK1

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
CN-111372931-B Heterocyclic compounds as protein kinase inhibitors 怡诺安有限公司 2023-03-24 CN disclosed