SCHEMBL22110347

SCHEMBL22110347

CC(C)C(=O)Nc1nc2c(-c3ccc(CN4CC(S(C)(=O)=O)C4)cc3)cccn2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 11/20 1.00
JAK3 P52333 12/20 0.68
JAK2 O60674 10/20 0.51
PTK2 Q05397 9/20 0.51

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
SCHEMBL21044810 0.92 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL21044831 0.91 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL19823053 0.89 JAK1 (0.80) JAK1JAK3JAK2PTK2
SCHEMBL19823050 0.88 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL21078397 0.86 JAK1 (0.76) JAK1JAK3JAK2PTK2
SCHEMBL19823063 0.86 JAK1 (0.76) JAK1JAK3JAK2PTK2
SCHEMBL24062643 0.84 JAK1 (0.75) JAK1JAK3JAK2PTK2
SCHEMBL21044840 0.81 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL21044824 0.80 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL21044823 0.79 JAK1 (0.84) JAK1JAK3JAK2PTK2

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
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof SUZHOU LONGBIOTECH PHARMACEUTICALS CO., LTD. (CN) 2022-03-22 US disclosed
US-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF TIANJIN LONGBOGENE PHARMACEUTICAL CO., LTD. (CN) 2020-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF JAK1, JAK2, JAK3 JAK1 1/4885JAK3 3/4885JAK2 2/4885
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof JAK1, JAK2, JAK3 JAK1 1/4885JAK3 3/4885JAK2 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.