SCHEMBL23826239

SCHEMBL23826239

CC(=O)C[C@@H]1CCN(C(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.40
TACR3 P29371 1/20 0.37
ALDH1A1 P00352 2/20 0.36
NPC1 O15118 1/20 0.36
DPP8 Q6V1X1 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
CPN1 P15169 1/20 0.33
CPB2 Q96IY4 1/20 0.33
ACHE P22303 1/20 0.33
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTR2B P41595 1/20 0.32
MAPK14 Q16539 1/20 0.32

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
SCHEMBL23826754 1.00 AKR1C3 (0.40) AKR1C3TACR3ALDH1A1NPC1DPP8
SCHEMBL27095107 0.89 KDM4E (0.38) ALDH1A1NPC1
SCHEMBL3904129 0.88 AKR1C3 (0.44) AKR1C3ALDH1A1NPC1CPN1CPB2
SCHEMBL2875617 0.84 SLC6A1 (0.39) TACR3ALDH1A1
SCHEMBL2874106 0.84 SLC6A1 (0.39) TACR3ALDH1A1
SCHEMBL2874098 0.84 SLC6A1 (0.39) TACR3ALDH1A1
SCHEMBL23298052 0.84 CHRNB2 (0.31) AKR1C3
Acetic Acid SCHEMBL1772042 0.81 ITGB3 (0.36) TACR3DPP8DPP7CPN1CPB2
SCHEMBL22121234 0.81 LTA4H (0.39) TACR3ALDH1A1NPC1DPP8DPP7
SCHEMBL22750444 0.80 BRD4 (0.45) TACR3ALDH1A1NPC1

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 3 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 disclosed
EP-3882239-A1 1,3,4-OXADIAZOLONE COMPOUND AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2021-09-22 EP disclosed
CN-113302184-A 1,3, 4-oxadiazolinone compounds and drugs 日本新药株式会社 2021-08-24 CN 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 AKR1C3 1000/4885TACR3 3783/4885ALDH1A1 274/4885

“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.