SCHEMBL15699138

SCHEMBL15699138

Oc1ccc2ncc(-c3cccc(OC(F)(F)F)c3)n2n1

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 12/20 0.76
PIM1 P11309 7/20 0.69
FYN P06241 1/20 0.66

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
SCHEMBL102421 0.89 DYRK1A (0.91) DYRK1APIM1FYN
SCHEMBL14653586 0.88 DYRK1A (0.73) DYRK1APIM1
SCHEMBL102330 0.88 DYRK1A (0.73) DYRK1APIM1
SCHEMBL29436156 0.88 DYRK1A (0.73) DYRK1APIM1
SCHEMBL26745373 0.86 DYRK1A (1.00) DYRK1APIM1FYN
SCHEMBL19987042 0.84 PIM1 (0.76) DYRK1APIM1FYN
SCHEMBL24333076 0.83 DYRK1A (1.00) DYRK1AFYN
SCHEMBL13867672 0.83 PIM1 (0.77) DYRK1APIM1
SCHEMBL14373133 0.83 FYN (0.73) DYRK1AFYN
SCHEMBL24333204 0.83 DYRK1A (1.00) DYRK1APIM1FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140135323-A1 OXO-SUBSTITUTED IMIDAZO[1,2B]PYRIDAZINES, THEIR PREPARATION AND USE AS PHARMACEUTICALS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-05-15 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-20140135323-A1 OXO-SUBSTITUTED IMIDAZO[1,2B]PYRIDAZINES, THEIR PREPARATION AND USE AS PHARMACEUTICALS CDK2, CDK1, MAP4K2 DYRK1A 445/4885PIM1 712/4885FYN 363/4885

“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.