Sugi Predict

Sugi Predict / Compounds / SCHEMBL29635110

SCHEMBL29635110

SCHEMBL29635110

N#CCC1CCN(c2nc(Nc3ccc(CN4CCC(C(=O)O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 17/20 1.00
▸ JAK2 O60674 14/20 0.75
▸ JAK1 P23458 1/20 0.69
▸ TYK2 P29597 1/20 0.69
▸ JAK3 P52333 1/20 0.69

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
SCHEMBL14716836 1.00 SYK (1.00) SYKJAK2JAK1TYK2JAK3
SCHEMBL14717229 0.93 SYK (0.87) SYKJAK2
SCHEMBL29635209 0.93 SYK (0.87) SYKJAK2
SCHEMBL14717018 0.91 SYK (0.83) SYKJAK2
SCHEMBL29635165 0.91 SYK (0.83) SYKJAK2
SCHEMBL20376719 0.90 SYK (0.82) SYKJAK2JAK1TYK2JAK3
SCHEMBL14729756 0.90 SYK (0.82) SYKJAK2
SCHEMBL30604798 0.90 SYK (0.81) SYKJAK2JAK1TYK2JAK3
SCHEMBL20376741 0.90 SYK (0.81) SYKJAK2JAK1TYK2JAK3
SCHEMBL14716793 0.89 SYK (0.82) SYKJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108707151-B Pyrimido-pyridazinone compounds and uses thereof 阿萨纳生物科技有限责任公司 2022-06-03 — — CN claimed
EP-4327886-A2 PYRIMIDO- PYRIDAZINONE COMPOUNDS AND USE THEREOF Libertas Bio, Inc. (US) 2024-02-28 — — EP disclosed
CN-108707151-B Pyrimido-pyridazinone compounds and uses thereof 阿萨纳生物科技有限责任公司 2022-06-03 — — CN disclosed