SCHEMBL26970754

SCHEMBL26970754

COC(=O)c1ccc(-c2nc(Nc3cnn(C4CC5CC[C@@H](C4)N5C(=O)OC(C)(C)C)c3)ncc2C)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 6/20 0.43
▸ JAK3 P52333 6/20 0.43
▸ JAK1 P23458 3/20 0.43
▸ TYK2 P29597 2/20 0.43
▸ PTK2 Q05397 1/20 0.40
▸ DYRK2 Q92630 1/20 0.40
▸ IGF1R P08069 1/20 0.39
▸ FLT4 P35916 1/20 0.38
▸ DDR2 Q16832 3/20 0.38
▸ GPR119 Q8TDV5 1/20 0.38
▸ FLT3 P36888 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
SCHEMBL24852475 1.00 JAK2 (0.43) JAK2JAK3JAK1TYK2PTK2
SCHEMBL30754120 1.00 JAK2 (0.43) JAK2JAK3JAK1TYK2PTK2
SCHEMBL24852446 0.88 JAK3 (0.52) JAK2JAK3PTK2DYRK2IGF1R
SCHEMBL22098035 0.88 DYRK2 (0.44) JAK2JAK3JAK1PTK2DYRK2
SCHEMBL24852530 0.88 IGF1R (0.46) JAK2JAK3JAK1TYK2IGF1R
SCHEMBL27445702 0.87 JAK3 (0.41) JAK2JAK3JAK1TYK2IGF1R
SCHEMBL28600657 0.86 IGF1R (0.41) JAK2JAK3JAK1PTK2DYRK2
SCHEMBL24853547 0.86 JAK3 (0.44) JAK2JAK3JAK1TYK2PTK2
SCHEMBL30754127 0.86 JAK3 (0.39) JAK2JAK3JAK1TYK2IGF1R
SCHEMBL27058973 0.86 JAK3 (0.39) JAK2JAK3JAK1TYK2IGF1R

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
US-20230416235-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-12-28 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230416235-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF JAK1, JAK3, JAK2 JAK2 3/4885JAK3 2/4885JAK1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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