SCHEMBL5814029

SCHEMBL5814029

Clc1ncnc2c1c(Br)nn2C1CCC2(CC1)OCCO2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.39
▸ JAK3 P52333 4/20 0.39
▸ JAK1 P23458 3/20 0.39
▸ EGFR P00533 8/20 0.37
▸ SRC P12931 7/20 0.34
▸ KDR P35968 7/20 0.34
▸ PIK3CD O00329 6/20 0.34
▸ ABL1 P00519 6/20 0.34
▸ HCK P08631 6/20 0.34
▸ PIK3CA P42336 6/20 0.34
▸ PIK3CB P42338 6/20 0.34
▸ MTOR P42345 6/20 0.34
▸ PIK3CG P48736 6/20 0.34
▸ EPHB4 P54760 6/20 0.34
▸ PRKDC P78527 6/20 0.34
▸ PI4KB Q9UBF8 3/20 0.34
▸ CSNK1A1 P48729 2/20 0.33
▸ CSNK1D P48730 2/20 0.33
▸ CSNK1E P49674 1/20 0.33
▸ RET P07949 6/20 0.33

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
SCHEMBL5814550 0.85 JAK2 (0.54) JAK2JAK3JAK1EGFRSRC
SCHEMBL30513350 0.85 JAK2 (0.54) JAK2JAK3JAK1EGFRSRC
SCHEMBL18642029 0.84 JAK2 (0.46) JAK2JAK3JAK1EGFRSRC
SCHEMBL1443178 0.73 ADK (0.47) SRCKDRABL1MTORCSNK1A1
SCHEMBL5805110 0.73 RET (0.64) JAK2JAK3EGFRSRCKDR
SCHEMBL29617723 0.73 RET (0.64) JAK2JAK3EGFRSRCKDR
SCHEMBL5816791 0.71 NR3C1 (0.46) JAK2JAK3JAK1
SCHEMBL5814555 0.70 RET (0.38) JAK2JAK3JAK1EGFRSRC
SCHEMBL30513264 0.69 EGFR (0.59) EGFRSRCKDRPIK3CDABL1
SCHEMBL6688373 0.68 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385524-A4 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO KG (DE) 2006-02-01 — — EP disclosed
US-6921763-B2 Pyrazolopyrimidines as therapeutic agents ABBOTT LABORATORIES (US) 2005-07-26 — — US disclosed
EP-1385524-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS Abbott GmbH & Co. KG (DE) 2004-02-04 — — EP disclosed
US-6660744-B1 Kinase inhibitors ABBOTT GMBH & CO. KG (DE) 2003-12-09 — — US disclosed
EP-1212327-B1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS BASF AG (DE) 2003-08-20 — — EP disclosed
US-20020156081-A1 Pyrazolopyrimidines as therapeutic agents ABBOTT LABORATORIES (US) 2002-10-24 — — US disclosed
WO-2002080926-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO. KG (DE) 2002-10-17 — — 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 (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-20020156081-A1 Pyrazolopyrimidines as therapeutic agents DPYD, CYP2D6, UGT1A1 JAK2 1212/4885JAK3 1066/4885JAK1 972/4885

“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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