SCHEMBL17350175

SCHEMBL17350175

CC(=O)c1cnc2c(ccn2COCC[Si](C)(C)C)c1N[C@H]1[C@@H]2C[C@@H]3C[C@H]1C[C@@](O)(C3)C2

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 9/20 0.45
JAK1 P23458 7/20 0.45
JAK2 O60674 6/20 0.45
TYK2 P29597 4/20 0.45
HSD11B1 P28845 10/20 0.39

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
SCHEMBL14708344 1.00 JAK3 (0.45) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL17350087 1.00 JAK3 (0.45) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL17350088 1.00 JAK3 (0.45) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL14697424 1.00 JAK3 (0.45) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL14697519 0.93 JAK3 (0.54) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL17350174 0.93 JAK3 (0.54) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL16477599 0.93 JAK3 (0.54) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL17350173 0.93 JAK3 (0.54) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL17350212 0.93 JAK3 (0.54) JAK3JAK1JAK2TYK2HSD11B1
SCHEMBL566820 0.91 JAK1 (0.42) JAK3JAK1JAK2TYK2HSD11B1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9556187-B2 Substituted pyrrolo[3′,2′:5,6]pyrido[4,3-d]pyrimidines and JAK inhibitors comprising the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2017-01-31 US disclosed
EP-3112370-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS AND JAK INHIBITORS Nissan Chemical Industries, Ltd. (JP) 2017-01-04 EP disclosed
US-20160102102-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS AND JAK INHIBITORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-04-14 US disclosed
US-9216999-B2 Substituted pyrrolo[2,3-h][1,6]naphthyridines and compositions thereof as JAK inhibitors NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-22 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 (1 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-20160102102-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS AND JAK INHIBITORS JAK2, JAK1, JAK3 JAK3 3/4885JAK1 2/4885JAK2 1/4885

“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.