SCHEMBL23827113

SCHEMBL23827113

CC(Nc1cc(C(=O)O)cc(F)c1Cl)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 1/20 0.40
▸ STS P08842 5/20 0.40
▸ GPR119 Q8TDV5 6/20 0.39
▸ USP30 Q70CQ3 2/20 0.39
▸ TRPV3 Q8NET8 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ DPP4 P27487 1/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 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
SCHEMBL23827110 1.00 TOP2A (0.40) TOP2ASTSGPR119USP30TRPV3
SCHEMBL23826863 0.88 STS (0.40) STSGPR119USP30TRPV3DPP4
SCHEMBL23826314 0.88 STS (0.40) STSGPR119USP30TRPV3DPP4
SCHEMBL23826310 0.87 STS (0.37) STSGPR119USP30TRPV3DPP4
SCHEMBL23826312 0.87 STS (0.37) STSGPR119USP30TRPV3DPP4
SCHEMBL23825793 0.85 TOP2A (0.45) TOP2ASTSGPR119USP30NPC1
SCHEMBL23825792 0.85 TOP2A (0.45) TOP2ASTSGPR119USP30NPC1
SCHEMBL28616764 0.79 GPR119 (0.46) STSGPR119NPC1ALDH1A1MAPT
SCHEMBL28616763 0.79 GPR119 (0.46) STSGPR119NPC1ALDH1A1MAPT
SCHEMBL23826400 0.76 TOP2A (0.45) TOP2ASTSGPR119NPC1ALDH1A1

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 disclosed
EP-3882239-A1 1,3,4-OXADIAZOLONE COMPOUND AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2021-09-22 — — EP 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 TOP2A 2604/4885STS 396/4885GPR119 3488/4885

“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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