SCHEMBL30121827

SCHEMBL30121827

NC(=O)c1cnc(Nc2ccc3c(c2)NCC(O)CO3)nc1NCc1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 2/20 0.53
▸ STAT6 P42226 10/20 0.47
▸ SYK P43405 3/20 0.46
▸ PTK2 Q05397 5/20 0.45
▸ PTK2B Q14289 3/20 0.45

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
SCHEMBL20759881 1.00 JAK3 (0.53) JAK3STAT6SYKPTK2PTK2B
SCHEMBL30122076 0.91 STAT6 (0.58) JAK3STAT6SYK
SCHEMBL20760050 0.91 STAT6 (0.58) JAK3STAT6SYK
SCHEMBL20759882 0.88 JAK3 (0.53) JAK3STAT6SYK
SCHEMBL30121692 0.88 JAK3 (0.53) JAK3STAT6SYK
SCHEMBL20759863 0.87 JAK2 (0.52) JAK3STAT6SYK
SCHEMBL30121840 0.87 JAK2 (0.52) JAK3STAT6SYK
SCHEMBL20760183 0.87 SYK (0.49) JAK3STAT6SYK
SCHEMBL30121873 0.87 SYK (0.49) JAK3STAT6SYK
SCHEMBL20761180 0.86 SYK (0.51) JAK3STAT6SYK

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-111032630-B Compound, pharmaceutical composition, application and application thereof 北京韩美药品有限公司 2022-12-16 — — CN disclosed
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