SCHEMBL27169601

SCHEMBL27169601

Cc1cnc(Nc2cnn(C3CCOCC3)c2)nc1-c1ccc(OCC2CC2)c(F)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 5/20 0.59
▸ MYLK4 Q86YV6 1/20 0.49
▸ STK17A Q9UEE5 1/20 0.49
▸ JAK1 P23458 7/20 0.46
▸ JAK3 P52333 7/20 0.46
▸ JAK2 O60674 5/20 0.46
▸ IKBKE Q14164 3/20 0.45
▸ TBK1 Q9UHD2 3/20 0.45
▸ TYK2 P29597 3/20 0.45
▸ EIF2AK4 Q9P2K8 1/20 0.45
▸ CDK4 P11802 3/20 0.43
▸ CDK6 Q00534 3/20 0.43
▸ CCNA2 P20248 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ PIK3CD O00329 2/20 0.43
▸ CSF1R P07333 2/20 0.43

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
SCHEMBL27169600 0.94 LRRK2 (0.56) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL27169579 0.93 LRRK2 (0.64) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL27169611 0.90 LRRK2 (0.59) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL27169585 0.90 LRRK2 (0.50) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL29754211 0.88 TBK1 (0.46) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL22544818 0.88 TBK1 (0.46) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL27169607 0.87 IKBKE (0.51) LRRK2IKBKETBK1CDK2
SCHEMBL27169592 0.86 LRRK2 (0.61) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL27169598 0.86 LRRK2 (0.48) LRRK2MYLK4STK17AJAK1JAK3
SCHEMBL22544570 0.86 LRRK2 (0.45) LRRK2MYLK4STK17AJAK1JAK3

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
US-12024503-B2 Benzethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-02 — — US disclosed
US-20240083882-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-03-14 — — 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 (2 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-12024503-B2 Benzethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof JAK3, JAK1, JAK2 LRRK2 1384/4885MYLK4 1765/4885STK17A 116/4885
US-20240083882-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF JAK3, JAK1, JAK2 LRRK2 1356/4885MYLK4 1808/4885STK17A 119/4885

“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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