SCHEMBL29922737

SCHEMBL29922737

NC(=O)c1nncc(-c2c(F)cccc2F)c1Nc1ccc(N2CCOCC2)cn1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 9/20 0.67
▸ JAK2 O60674 6/20 0.67
▸ JAK1 P23458 4/20 0.67
▸ JAK3 P52333 4/20 0.67
▸ DGAT1 O75907 1/20 0.47
▸ CDK4 P11802 1/20 0.44
▸ CCNA2 P20248 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ CCND3 P30281 1/20 0.44
▸ CDK6 Q00534 1/20 0.44
▸ STAT6 P42226 3/20 0.42
▸ LRRK2 Q5S007 4/20 0.42
▸ CSF1R P07333 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ MAPK9 P45984 1/20 0.39
▸ MAPK10 P53779 1/20 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
SCHEMBL29922578 0.92 TYK2 (0.58) TYK2JAK2JAK1JAK3DGAT1
SCHEMBL29922842 0.87 TYK2 (0.69) TYK2JAK2JAK1JAK3DGAT1
SCHEMBL29922509 0.86 TYK2 (0.52) TYK2JAK2JAK1JAK3DGAT1
SCHEMBL29923095 0.83 JAK2 (0.66) TYK2JAK2JAK1JAK3STAT6
SCHEMBL29922801 0.82 RAB9A (0.54) TYK2JAK2JAK1JAK3DGAT1
SCHEMBL29922670 0.80 TYK2 (0.50) TYK2JAK2JAK1JAK3CDK4
SCHEMBL28362658 0.80 TYK2 (1.00) TYK2JAK2JAK1JAK3DGAT1
SCHEMBL29922585 0.77 TYK2 (0.58) TYK2JAK2JAK1JAK3DGAT1
SCHEMBL29922505 0.76 JAK2 (0.46) TYK2JAK2JAK1JAK3LRRK2
SCHEMBL21384014 0.76 TYK2 (0.63) TYK2JAK2JAK1JAK3DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110818641-B Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2022-10-14 — — CN disclosed
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