SCHEMBL18356752

SCHEMBL18356752

N[C@H]1CC[C@H](Oc2ccc3ncc(-c4cccc(OC(F)(F)F)c4)n3n2)CC1

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 15/20 0.84
DYRK1A Q13627 5/20 0.59
KCNH2 Q12809 1/20 0.58

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
SCHEMBL136318 0.91 PIM1 (1.00) PIM1DYRK1AKCNH2
SCHEMBL102854 0.91 PIM1 (1.00) PIM1DYRK1AKCNH2
SCHEMBL19987066 0.90 PIM1 (0.84) PIM1DYRK1AKCNH2
SCHEMBL13867544 0.83 PIM1 (0.72) PIM1DYRK1AKCNH2
SCHEMBL3864352 0.83 PIM1 (0.71) PIM1DYRK1AKCNH2
SCHEMBL3865582 0.82 PIM1 (0.70) PIM1DYRK1AKCNH2
SCHEMBL102682 0.82 PIM1 (1.00) PIM1KCNH2
SCHEMBL16211078 0.82 PIM1 (1.00) PIM1KCNH2
SCHEMBL13867504 0.81 PIM1 (0.87) PIM1DYRK1AKCNH2
SCHEMBL23271173 0.80 PIM1 (0.66) PIM1DYRK1AKCNH2

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-20170002014-A1 SUBSTITUTED IMIDAZO[1,2-B]PYRIDAZINES AS PROTEIN KINASE INHIBITORS SUMITOMO PHARMA AMERICA, INC. 2017-01-05 US disclosed
US-20170002014-A1 SUBSTITUTED IMIDAZO[1,2-B]PYRIDAZINES AS PROTEIN KINASE INHIBITORS SUMITOMO PHARMA AMERICA, INC. 2017-01-05 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-20170002014-A1 SUBSTITUTED IMIDAZO[1,2-B]PYRIDAZINES AS PROTEIN KINASE INHIBITORS PIM1, PIM2, PIM3 PIM1 1/4885DYRK1A 171/4885KCNH2 1832/4885

“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.