SCHEMBL22089671

SCHEMBL22089671

Cc1cnc(Nc2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)nc1-c1ccc(C(=O)N2CC(C#N)C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 5/20 0.48
▸ JAK2 O60674 4/20 0.48
▸ PTK2 Q05397 1/20 0.48
▸ DYRK2 Q92630 1/20 0.46
▸ TTK P33981 2/20 0.44
▸ JAK1 P23458 2/20 0.44
▸ GPR119 Q8TDV5 2/20 0.43
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ TNK2 Q07912 1/20 0.42
▸ IGF1R P08069 7/20 0.42
▸ EGFR P00533 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ BTK Q06187 1/20 0.42
▸ CDK1 P06493 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ CDK7 P50613 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40

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
SCHEMBL29941953 1.00 JAK3 (0.48) JAK3JAK2PTK2DYRK2TTK
SCHEMBL22098060 0.90 IGF1R (0.49) JAK3JAK2JAK1IGF1RCDK1
SCHEMBL22097660 0.90 JAK2 (0.46) JAK3JAK2JAK1IGF1RCDK1
SCHEMBL22097698 0.90 JAK3 (0.47) JAK3JAK2JAK1IGF1R
SCHEMBL29941672 0.90 JAK3 (0.47) JAK3JAK2JAK1IGF1R
SCHEMBL30956374 0.88 DYRK2 (0.42) JAK3JAK2PTK2DYRK2JAK1
SCHEMBL27059072 0.88 JAK3 (0.45) JAK3JAK2DYRK2JAK1TBK1
SCHEMBL22114893 0.88 JAK3 (0.52) JAK3JAK2PTK2DYRK2TTK
Hydrochloric Acid SCHEMBL30956423 0.88 JAK3 (0.45) JAK3JAK2DYRK2JAK1TBK1
SCHEMBL24852446 0.87 JAK3 (0.52) JAK3JAK2PTK2DYRK2TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030870-B2 Benzamides of pyrazolylamino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-09 — — US disclosed
US-12030870-B2 Benzamides of pyrazolylamino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-09 — — US disclosed
US-20240025882-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-01-25 — — US disclosed
US-20240025882-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-01-25 — — US disclosed
US-20230002362-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-01-05 — — US disclosed
WO-2020118683-A1 BENZAMIDES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2020-06-18 — — WO 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 (3 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-12030870-B2 Benzamides of pyrazolylamino-pyrimidinyl derivatives, and compositions and methods thereof JAK2, JAK1, JAK3 JAK3 3/4885JAK2 1/4885PTK2 2032/4885
US-20230002362-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF JAK1, JAK3, JAK2 JAK3 2/4885JAK2 3/4885PTK2 1945/4885
US-20240025882-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF JAK2, JAK1, JAK3 JAK3 3/4885JAK2 1/4885PTK2 2032/4885

“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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