SCHEMBL30356239

SCHEMBL30356239

N#CCC(=O)NC1CCN(c2cc(NC(=O)C3CC3)nc3[nH]ccc23)CC1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 20/20 0.67

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
SCHEMBL20918736 1.00 JAK1 (0.67) JAK1
SCHEMBL20917855 0.85 JAK1 (0.76) JAK1
SCHEMBL30356121 0.85 JAK1 (0.76) JAK1
SCHEMBL20930844 0.82 JAK1 (0.62) JAK1
SCHEMBL20930399 0.81 JAK1 (0.68) JAK1
SCHEMBL30355955 0.80 JAK1 (1.00) JAK1
SCHEMBL20917867 0.80 JAK1 (1.00) JAK1
SCHEMBL30009288 0.80 AKT2 (0.57) JAK1
SCHEMBL20917918 0.80 JAK1 (0.57) JAK1
SCHEMBL20917914 0.80 JAK1 (0.57) 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