SCHEMBL14716601

SCHEMBL14716601

N#CCC1CCN(c2nc(Nc3ccc(N4CCC(CO)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1

nearest known ligand 0.87

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 15/20 0.87
SYK P43405 14/20 0.87
JAK1 P23458 1/20 0.87
TYK2 P29597 1/20 0.87
JAK3 P52333 1/20 0.87

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
SCHEMBL22101952 0.96 SYK (0.93) JAK2SYKJAK1TYK2JAK3
SCHEMBL14717350 0.93 JAK2 (0.86) JAK2SYKJAK1TYK2JAK3
SCHEMBL14717926 0.93 SYK (0.86) JAK2SYKJAK1TYK2JAK3
Gusacitinib SCHEMBL14717111 0.93 SYK (1.00) JAK2SYKJAK1TYK2JAK3
Gusacitinib SCHEMBL29467492 0.93 SYK (1.00) JAK2SYKJAK1TYK2JAK3
Gusacitinib SCHEMBL25373888 0.92 SYK (0.98) JAK2SYKJAK1TYK2JAK3
Gusacitinib SCHEMBL31038820 0.92 SYK (0.98) JAK2SYKJAK1TYK2JAK3
SCHEMBL14716645 0.92 SYK (1.00) JAK2SYKJAK1TYK2JAK3
SCHEMBL14716799 0.92 SYK (1.00) JAK2SYKJAK1TYK2JAK3
SCHEMBL14717214 0.92 SYK (0.89) JAK2SYKJAK1TYK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3392252-B1 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF LIBERTAS BIO INC (US) 2023-10-04 EP claimed
US-20200190095-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF ABS DEVELOPMENT 1, INC. 2020-06-18 US claimed
US-10647720-B2 Pyrimido-pyridazinone compounds and methods of use thereof Asan BioSciences, LLC (US) 2020-05-12 US claimed
US-20190092779-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF Libertas Bio, Inc. 2019-03-28 US claimed
US-20190070182-A1 USES OF PYRIMIDO-PYRIDAZINONES TO TREAT CANCER ASANA BIOSCIENCES, LLC 2019-03-07 US claimed
US-10183944-B2 Pyrimido-pyridazinone compounds and methods of use thereof ASANA BIOSCIENCES, LLC (US) 2019-01-22 US claimed
EP-3404029-A2 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS AND USE THEREOF Asana BioSciences, LLC (US) 2018-11-21 EP claimed
EP-3392252-A1 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF Asana BioSciences, LLC (US) 2018-10-24 EP claimed
EP-2748166-B1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND USE THEREOF ASANA BIOSCIENCES LLC (US) 2018-07-11 EP claimed
US-20170157126-A1 USES OF PYRIMIDO-PYRIDAZINONES TO TREAT CANCER ASANA BIOSCIENCES, LLC (US) 2017-06-08 US claimed
US-20160257691-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF Libertas Bio, Inc. 2016-09-08 US claimed
US-9382277-B2 Pyrimido-pyridazinone compounds and methods of use thereof ASANA BIOSCIENCES, LLC (US) 2016-07-05 US claimed
EP-2748166-A1 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF Endo Pharmaceuticals Inc. (US) 2014-07-02 EP claimed
US-8729079-B2 Pyrimido-pyridazinone compounds and methods of use thereof ENDO PHARMACEUTICALS INC. (US) 2014-05-20 US claimed
US-20130053346-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF ENDO PHARMACEUTICALS INC (US) 2013-02-28 US claimed
WO-2013028818-A1 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF ENDO PHARMACEUTICALS INC. (US) 2013-02-28 WO claimed
EP-4327886-A2 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF Libertas Bio, Inc. (US) 2024-02-28 EP disclosed
EP-3392252-B1 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF LIBERTAS BIO INC (US) 2023-10-04 EP disclosed
US-8729079-B2 Pyrimido-pyridazinone compounds and methods of use thereof ENDO PHARMACEUTICALS INC. (US) 2014-05-20 US disclosed
US-20130053346-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF ENDO PHARMACEUTICALS INC (US) 2013-02-28 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 (8 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-10183944-B2 Pyrimido-pyridazinone compounds and methods of use thereof THPO, TYMP, TYMS JAK2 139/4885SYK 741/4885JAK1 173/4885
US-20190070182-A1 USES OF PYRIMIDO-PYRIDAZINONES TO TREAT CANCER MKI67, DPYD, TYMP JAK2 350/4885SYK 919/4885JAK1 627/4885
US-20160257691-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF THPO, TYMP, TYMS JAK2 139/4885SYK 741/4885JAK1 173/4885
US-20170157126-A1 USES OF PYRIMIDO-PYRIDAZINONES TO TREAT CANCER MKI67, DPYD, TYMP JAK2 350/4885SYK 919/4885JAK1 627/4885
US-20190092779-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF THPO, TYMP, TYMS JAK2 139/4885SYK 741/4885JAK1 173/4885
US-20200190095-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF THPO, TYMP, TYMS JAK2 139/4885SYK 741/4885JAK1 173/4885
US-10647720-B2 Pyrimido-pyridazinone compounds and methods of use thereof THPO, TYMP, TYMS JAK2 139/4885SYK 741/4885JAK1 173/4885
US-20130053346-A1 PYRIMIDO-PYRIDAZINONE COMPOUNDS AND METHODS OF USE THEREOF THPO, TYMP, TYMS JAK2 139/4885SYK 741/4885JAK1 173/4885

“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.