SCHEMBL17394775

SCHEMBL17394775

COc1cc2[nH]ncc2cc1Nc1ncnc2[nH]ncc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 13/20 1.00
▸ LCK P06239 2/20 0.62
▸ PDPK1 O15530 1/20 0.54
▸ RET P07949 3/20 0.54
▸ KDR P35968 1/20 0.54
▸ KIF5B P33176 1/20 0.54
▸ ROCK2 O75116 1/20 0.51

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
SCHEMBL17063662 0.87 MKNK1 (0.77) MKNK1LCKRETKDRROCK2
SCHEMBL16961583 0.87 MKNK1 (0.77) MKNK1RETKDR
SCHEMBL15921201 0.86 MKNK1 (1.00) MKNK1LCK
SCHEMBL17063668 0.86 MKNK1 (0.75) MKNK1LCKRETKDRROCK2
SCHEMBL16961903 0.86 MKNK1 (0.75) MKNK1LCKRETKDRROCK2
SCHEMBL29919772 0.84 MKNK1 (0.72) MKNK1ROCK2
SCHEMBL28936225 0.84 MKNK1 (0.72) MKNK1ROCK2
SCHEMBL28936235 0.84 MKNK1 (0.72) MKNK1LCKROCK2
SCHEMBL29919730 0.84 MKNK1 (0.72) MKNK1LCKROCK2
SCHEMBL28936127 0.83 MKNK1 (0.71) MKNK1RETKDRROCK2

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-2951175-B1 SUBSTITUTED PYRAZOLOPYRIMIDINYLAMINO-INDAZOLES Bayer Pharma AG (DE) 2017-10-04 — — EP claimed
US-9556181-B2 Substituted pyrazolopyrimidinylamino-indazoles BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-31 — — US claimed
US-20160002245-A1 SUBSTITUTED PYRAZOLOPYRIMIDINYLAMINO-INDAZOLES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-07 — — US claimed
EP-2951175-B1 SUBSTITUTED PYRAZOLOPYRIMIDINYLAMINO-INDAZOLES Bayer Pharma AG (DE) 2017-10-04 — — EP disclosed
EP-2951175-B1 SUBSTITUTED PYRAZOLOPYRIMIDINYLAMINO-INDAZOLES Bayer Pharma AG (DE) 2017-10-04 — — EP disclosed
US-9556181-B2 Substituted pyrazolopyrimidinylamino-indazoles BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-31 — — US disclosed
US-20160002245-A1 SUBSTITUTED PYRAZOLOPYRIMIDINYLAMINO-INDAZOLES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-07 — — 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-20160002245-A1 SUBSTITUTED PYRAZOLOPYRIMIDINYLAMINO-INDAZOLES VEGFA, PGF, MKI67 MKNK1 1172/4885LCK 1211/4885PDPK1 76/4885

“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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