SCHEMBL29366138

SCHEMBL29366138

NC1CCN(c2cc(-c3nnco3)ccc2C(F)(F)F)CC1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 17/20 0.76
SCD O00767 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL21776815 0.87 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL23451688 0.84 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL23825547 0.76 NOTUM (0.78) NOTUM
Hydrochloric Acid SCHEMBL23826941 0.76 NOTUM (0.76) NOTUM
SCHEMBL23451698 0.75 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL21776876 0.75 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL30412199 0.75 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL21776961 0.74 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL21776973 0.71 NOTUM (1.00) NOTUM
SCHEMBL30412767 0.71 NOTUM (1.00) NOTUM

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-20220024921-A1 1,3,4-OXADIAZOLONE COMPOUND AND PHARMACEUTICAL NIPPON SHINYAKU CO., LTD. (JP) 2022-01-27 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-20220024921-A1 1,3,4-OXADIAZOLONE COMPOUND AND PHARMACEUTICAL PIM1, PIM3, PIM2 NOTUM 1103/4885SCD 3610/4885KDM4E 458/4885

“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.