SCHEMBL25838908

SCHEMBL25838908

COCC1C[C@@H](NC(=O)c2ncc(-c3cc(C(F)(F)F)ccc3OC3CC3)o2)CN1C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 3/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ HDAC6 Q9UBN7 5/20 0.32
▸ HDAC4 P56524 3/20 0.32
▸ CRHR1 P34998 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ HDAC1 Q13547 3/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ PTK2 Q05397 1/20 0.32
▸ BTK Q06187 2/20 0.31
▸ GPR6 P46095 1/20 0.31
▸ EIF2AK4 Q9P2K8 1/20 0.31

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
SCHEMBL24073210 1.00 PDE4B (0.34) PDE4BRIPK1HDAC6HDAC4CRHR1
SCHEMBL25308018 0.92 RIPK1 (0.34) RIPK1HDAC6CRHR1MRGPRX4HDAC1
SCHEMBL30468020 0.89 IRAK4 (0.36) PDE4BGPR6
SCHEMBL30468056 0.89 IRAK4 (0.36) PDE4BGPR6
SCHEMBL25838644 0.89 PDE4B (0.35) PDE4BRIPK1HDAC6HDAC4JAK2
SCHEMBL24073575 0.89 PDE4B (0.35) PDE4BRIPK1HDAC6HDAC4JAK2
SCHEMBL24073560 0.86 CETP (0.35) HDAC6CRHR1HDAC1BTKGPR6
SCHEMBL24073558 0.86 CETP (0.35) HDAC6CRHR1HDAC1BTKGPR6
SCHEMBL24073211 0.86 CETP (0.35) HDAC6CRHR1HDAC1BTKGPR6
SCHEMBL27418557 0.86 CETP (0.35) HDAC6CRHR1HDAC1BTKGPR6

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
EP-4157834-B1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION MISSION THERAPEUTICS LTD (GB) 2024-07-03 — — EP disclosed
US-20230219939-A1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION MISSION THERAPEUTICS LIMITED (GB) 2023-07-13 — — 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-20230219939-A1 N-(1-CYANO-PYRROLIDIN-3-YL)-5-(3-(TRIFLUOROMETHYL)PHENYL)OXAZOLE-2-CARBOXAMIDE DERIVATIVES AND THE CORRESPONDING OXADIAZOLE DERIVATIVES AS USP30 INHIBITORS FOR THE TREATMENT OF MITOCHONDRIAL DYSFUNCTION USP30, UQCRC1, NDUFAF1 PDE4B 1356/4885RIPK1 2377/4885HDAC6 356/4885

“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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