SCHEMBL29366142

SCHEMBL29366142

CC(C)(C)OC(=O)NC1CCC(Nc2cc(C(=O)NN)ccc2Br)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.42
▸ KDM1A O60341 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.40
▸ BTK Q06187 4/20 0.40
▸ DRD2 P14416 6/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALOX15 P16050 1/20 0.37
▸ KCNA3 P22001 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ EPHX2 P34913 1/20 0.36
▸ TNF P01375 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36

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
SCHEMBL23825840 0.88 KDM1A (0.46) KDM1AMAOBHDAC8BTKDRD2
SCHEMBL23825838 0.88 KDM1A (0.46) KDM1AMAOBHDAC8BTKDRD2
SCHEMBL23826085 0.85 ALOX15 (0.49) KDM1AMAOBBTKDRD2ALOX15
SCHEMBL23826087 0.85 ALOX15 (0.49) KDM1AMAOBBTKDRD2ALOX15
SCHEMBL23826431 0.83 MAPK14 (0.48) MAPK14HDAC8KMT2AALOX15
SCHEMBL23826428 0.83 MAPK14 (0.48) MAPK14HDAC8KMT2AALOX15
SCHEMBL23826896 0.80 HDAC8 (0.43) MAPK14HDAC8LMNAKMT2AALOX15
SCHEMBL23825779 0.77 DRD2 (0.42) KDM1AMAOBDRD2KMT2AL3MBTL1
SCHEMBL23826504 0.74 KDM1A (0.41) KDM1AMAOBBTKDRD2NAMPT
SCHEMBL25042395 0.74 KDM1A (0.45) KDM1AMAOBBTKDRD2NAMPT

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
CN-113302184-B 1,3, 4-Oxadiazolinone compounds and medicaments 日本新药株式会社 2024-11-22 — — CN disclosed
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 MAPK14 2075/4885KDM1A 334/4885MAOB 2103/4885

“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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