SCHEMBL28600657

SCHEMBL28600657

COC(=O)c1ccc(-c2nc(Nc3cnn(C4CCN(C(=O)OC(C)(C)C)C(n5cc(Nc6ncc(C)c(-c7ccc(C(=O)OC)cc7)n6)cn5)C4)c3)ncc2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 8/20 0.41
▸ JAK2 O60674 5/20 0.41
▸ JAK3 P52333 5/20 0.41
▸ PTK2 Q05397 1/20 0.41
▸ JAK1 P23458 2/20 0.40
▸ DYRK2 Q92630 1/20 0.40
▸ FLT4 P35916 1/20 0.38
▸ GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL30956458 0.93 DYRK2 (0.42) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL29249023 0.91 FLT4 (0.42) IGF1RJAK2JAK3PTK2FLT4
SCHEMBL30956628 0.90 DYRK2 (0.40) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL24852446 0.89 JAK3 (0.52) IGF1RJAK2JAK3PTK2DYRK2
SCHEMBL26970754 0.86 JAK2 (0.43) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL24852475 0.86 JAK2 (0.43) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL30754120 0.86 JAK2 (0.43) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL22098035 0.85 DYRK2 (0.44) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL24853547 0.85 JAK3 (0.44) IGF1RJAK2JAK3PTK2JAK1
SCHEMBL24852530 0.83 IGF1R (0.46) IGF1RJAK2JAK3JAK1

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-118290403-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-05 — — CN disclosed
CN-113227074-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl derivatives, compositions and methods 凌科药业(杭州)有限公司 2021-08-06 — — CN disclosed
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