SCHEMBL29635145

SCHEMBL29635145

N#CCC(=O)N1CCC(c2nc(Nc3ccc(CN4CCC(C(=O)O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.67
JAK2 O60674 12/20 0.64

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
SCHEMBL14716665 1.00 SYK (0.67) SYKJAK2
SCHEMBL30604864 0.92 SYK (0.56) SYKJAK2
SCHEMBL14717200 0.91 SYK (0.64) SYKJAK2
SCHEMBL20661563 0.91 SYK (0.56) SYKJAK2
SCHEMBL20376644 0.90 SYK (0.55) SYKJAK2
SCHEMBL29635187 0.90 SYK (0.63) SYKJAK2
SCHEMBL14717311 0.90 SYK (0.63) SYKJAK2
SCHEMBL14716819 0.89 SYK (0.53) SYKJAK2
SCHEMBL20376647 0.89 SYK (0.54) SYKJAK2
SCHEMBL29635070 0.88 SYK (0.80) 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 2 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
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