SCHEMBL15546366

SCHEMBL15546366

Cc1cnc(Nc2cnn(CC(=O)NC3CC3)c2)nc1NCc1cc(F)ccc1F

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 18/20 0.61
JAK2 O60674 11/20 0.61
JAK1 P23458 9/20 0.61
NTRK1 P04629 1/20 0.46
STAT6 P42226 1/20 0.46

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
SCHEMBL19417543 0.92 JAK3 (0.52) JAK3JAK2JAK1
SCHEMBL16782601 0.90 JAK3 (0.61) JAK3JAK2JAK1STAT6
SCHEMBL16782442 0.88 JAK3 (0.50) JAK3JAK2JAK1
SCHEMBL15547424 0.87 JAK3 (0.52) JAK3JAK2JAK1
SCHEMBL15547988 0.87 JAK3 (0.59) JAK3JAK2JAK1NTRK1
SCHEMBL16782587 0.85 JAK3 (0.57) JAK3JAK2JAK1
SCHEMBL15547290 0.82 JAK3 (0.56) JAK3JAK2JAK1NTRK1
SCHEMBL16782526 0.82 JAK3 (0.63) JAK3JAK2JAK1
SCHEMBL15546925 0.81 JAK3 (0.62) JAK3JAK2JAK1
SCHEMBL15559205 0.80 JAK3 (0.59) JAK3JAK2JAK1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2855451-B1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS CELLZOME LTD (GB) 2017-10-04 EP claimed
US-9655897-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2017-05-23 US claimed
US-20160184307-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors CELLZOME LIMITED (GB) 2016-06-30 US claimed
US-9296725-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2016-03-29 US claimed
US-20150166513-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors CELLZOME LIMITED (GB) 2015-06-18 US claimed
EP-2855451-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS Cellzome Limited (GB) 2015-04-08 EP claimed
WO-2013174895-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS CELLZOME LIMITED (GB) 2013-11-28 WO claimed
EP-2855451-B1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS CELLZOME LTD (GB) 2017-10-04 EP disclosed
EP-2855451-B1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS CELLZOME LTD (GB) 2017-10-04 EP disclosed
US-9655897-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2017-05-23 US disclosed
US-9655897-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2017-05-23 US disclosed
US-9655897-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2017-05-23 US disclosed
US-20160184307-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors CELLZOME LIMITED (GB) 2016-06-30 US disclosed
US-9296725-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2016-03-29 US disclosed
US-9296725-B2 Heterocyclyl pyrimidine analogues as TYK2 inhibitors CELLZOME LIMITED (GB) 2016-03-29 US disclosed
US-20150166513-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors CELLZOME LIMITED (GB) 2015-06-18 US disclosed
US-20150166513-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors CELLZOME LIMITED (GB) 2015-06-18 US disclosed
US-20150166513-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors CELLZOME LIMITED (GB) 2015-06-18 US disclosed
EP-2855451-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS Cellzome Limited (GB) 2015-04-08 EP disclosed
WO-2013174895-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS TYK2 INHIBITORS CELLZOME LIMITED (GB) 2013-11-28 WO 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-20150166513-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors TYK2, TXK, IRAK1 JAK3 15/4885JAK2 10/4885JAK1 6/4885
US-20160184307-A1 Heterocyclyl Pyrimidine Analogues As TYK2 Inhibitors TYK2, TXK, IRAK1 JAK3 15/4885JAK2 10/4885JAK1 6/4885

“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.