SCHEMBL29363056

SCHEMBL29363056

CC(C)(C)OC(=O)NCc1ccc(-c2cc(-c3n[nH]c(=O)o3)ccc2C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 17/20 0.51
▸ CYP1A2 P05177 1/20 0.46
▸ IL2 P60568 1/20 0.42
▸ GRM2 Q14416 1/20 0.41
▸ HPN P05981 1/20 0.41

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
SCHEMBL23825685 0.86 NOTUM (0.54) NOTUMCYP1A2IL2
SCHEMBL7290389 0.86 NOTUM (0.54) NOTUMCYP1A2
SCHEMBL28614218 0.85 NOTUM (0.46) NOTUMCYP1A2
SCHEMBL31336425 0.79 NOTUM (0.50) NOTUMCYP1A2
SCHEMBL29366780 0.79 NOTUM (0.50) NOTUMCYP1A2
SCHEMBL29366281 0.78 BRD4 (0.49) NOTUMCYP1A2IL2
SCHEMBL31335498 0.78 NOTUM (0.57) NOTUMCYP1A2
SCHEMBL23825802 0.78 NOTUM (0.57) NOTUMCYP1A2
Hydrochloric Acid SCHEMBL23827016 0.77 NOTUM (0.56) NOTUMCYP1A2
SCHEMBL23825566 0.76 NOTUM (0.55) NOTUMCYP1A2

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-20220024921-A1 1,3,4-OXADIAZOLONE COMPOUND AND PHARMACEUTICAL NIPPON SHINYAKU CO., LTD. (JP) 2022-01-27 — — US claimed
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 1103/4885CYP1A2 1082/4885IL2 462/4885

“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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