SCHEMBL24577209

SCHEMBL24577209

Cc1cnn2cc(-c3cnn(CC(O)CO)c3)sc12

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 20/20 0.39
▸ JAK1 P23458 20/20 0.39
▸ TYK2 P29597 20/20 0.39
▸ JAK3 P52333 20/20 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
SCHEMBL24577085 0.82 KIT (0.39) JAK2JAK1TYK2JAK3
SCHEMBL24577471 0.75 BACE1 (0.40) JAK2
SCHEMBL24577874 0.73 FLT3 (0.38) JAK2JAK1TYK2
SCHEMBL24579168 0.72 KIT (0.43) JAK2JAK1TYK2JAK3
SCHEMBL15986683 0.69 NOS1 (0.39) JAK2JAK1TYK2JAK3
SCHEMBL17382012 0.69 NOS1 (0.39) JAK2JAK1TYK2JAK3
SCHEMBL12460156 0.69 NOS1 (0.39) JAK2JAK1TYK2JAK3
SCHEMBL24578796 0.68 MAP4K1 (0.31) —
SCHEMBL24578878 0.67 KDR (0.38) —
SCHEMBL15973719 0.66 MAPT (0.40) JAK2JAK1TYK2JAK3

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
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — WO disclosed
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