SCHEMBL6430386

SCHEMBL6430386

Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)nc1)nn2C1CCC2(CC1)OCCO2

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 19/20 0.61
▸ LCK P06239 2/20 0.61
▸ LYN P07948 1/20 0.61
▸ BLK P51451 2/20 0.58
▸ FGR P09769 1/20 0.58
▸ FLT3 P36888 1/20 0.58
▸ CSK P41240 1/20 0.58
▸ JAK3 P52333 1/20 0.58
▸ ITK Q08881 1/20 0.58
▸ NUDT14 O95848 1/20 0.57
▸ NUDT5 Q9UKK9 1/20 0.57
▸ EGFR P00533 2/20 0.54
▸ SRC P12931 1/20 0.54
▸ KDR P35968 1/20 0.54
▸ TEK Q02763 1/20 0.54

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
SCHEMBL5805229 0.90 BTK (0.75) BTKLCKLYNBLKFGR
SCHEMBL22720779 0.85 BTK (0.70) BTKLCKLYNBLKFGR
SCHEMBL29439195 0.85 BTK (0.70) BTKLCKLYNBLKFGR
SCHEMBL30416088 0.85 BTK (0.66) BTKLCKLYNBLKFGR
SCHEMBL24197239 0.85 BTK (0.66) BTKLCKLYNBLKFGR
SCHEMBL6431891 0.84 BTK (0.66) BTKLCKLYNBLKFGR
SCHEMBL25468776 0.84 BTK (0.81) BTKLCKLYNBLKFGR
SCHEMBL5823929 0.83 BTK (0.61) BTKLCKLYNBLKFGR
SCHEMBL22902864 0.83 BTK (0.64) BTKLCKLYNBLKFGR
SCHEMBL25466396 0.82 BTK (0.67) BTKLCKLYNBLKFGR

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
US-6921763-B2 Pyrazolopyrimidines as therapeutic agents ABBOTT LABORATORIES (US) 2005-07-26 — — US disclosed
EP-1212327-B8 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO KG (DE) 2004-02-25 — — 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
EP-1212327-A2 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS BASF AKTIENGESELLSCHAFT (DE) 2002-06-12 — — EP disclosed
WO-2001019829-A2 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-22 — — 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 BTK 1020/4885LCK 1011/4885LYN 1034/4885

“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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