SCHEMBL14662047

SCHEMBL14662047

OCC(Nc1nc(Cl)ncc1Cl)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 13/20 0.46
▸ CCNC P24863 1/20 0.46
▸ CDK8 P49336 1/20 0.46
▸ NTRK1 P04629 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ AURKA O14965 2/20 0.42
▸ RPS6KB1 P23443 2/20 0.42

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
SCHEMBL14670573 1.00 EGFR (0.46) EGFRCCNCCDK8NTRK1LMNA
SCHEMBL14662045 1.00 EGFR (0.46) EGFRCCNCCDK8NTRK1LMNA
SCHEMBL14670576 0.89 EGFR (0.46) EGFRCCNCCDK8NTRK1RPS6KB1
SCHEMBL14670409 0.87 EGFR (0.43) EGFRCCNCCDK8NTRK1SMN1; SMN2
SCHEMBL14670665 0.86 EGFR (0.45) EGFRCCNCCDK8NTRK1LMNA
SCHEMBL14670585 0.86 USP1 (0.51) EGFRCCNCCDK8LMNAHPGD
SCHEMBL14670658 0.86 EGFR (0.45) EGFRCCNCCDK8NTRK1LMNA
SCHEMBL14670663 0.86 USP1 (0.51) EGFRCCNCCDK8LMNAHPGD
SCHEMBL13649008 0.86 NTRK1 (0.47) EGFRCCNCCDK8NTRK1LMNA
SCHEMBL30930020 0.86 NTRK1 (0.47) EGFRCCNCCDK8NTRK1LMNA

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-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
EP-2736901-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS JAK INHIBITORS Cellzome Limited (GB) 2014-06-04 — — EP disclosed
CN-103781780-A Heterocyclyl pyrimidine analogues as JAK inhibitors CELLZOME LTD 2014-05-07 — — CN disclosed
WO-2013014162-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2013-01-31 — — WO disclosed
WO-2013014162-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2013-01-31 — — 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-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors JAK1, JAK3, JAK2 EGFR 1927/4885CCNC 1077/4885CDK8 150/4885

“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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