SCHEMBL22716682

SCHEMBL22716682

CC(C)(C)OC(=O)N1CCC(Nc2cc(F)ccc2[N+](=O)[O-])CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MAPT P10636 6/20 0.52
MAPK1 P28482 2/20 0.52
HTT P42858 2/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
DNMT3A Q9Y6K1 1/20 0.45
GPR119 Q8TDV5 2/20 0.45
CCNT1 O60563 1/20 0.44
CDK9 P50750 1/20 0.44
MMP13 P45452 1/20 0.43
CNR1 P21554 1/20 0.43
BRD3 Q15059 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL30870562 0.92 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL22716841 0.92 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL11900568 0.89 MAPT (0.44) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL22587819 0.88 ALDH1A1 (0.51) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL606162 0.88 ALDH1A1 (0.51) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL22605777 0.88 MAPK1 (0.48) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL4635973 0.88 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL28696655 0.88 ALDH1A1 (0.50) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL18425295 0.87 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1HTTNPC1
SCHEMBL22605844 0.87 ALDH1A1 (0.63) ALDH1A1MAPTMAPK1HTTNPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3976604-B1 1,3,4-OXADIAZOLE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2026-01-21 EP disclosed
US-20230092890-A1 1, 3, 4-Oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same CHONG KUN DANG PHARMACEUTICAL CORPORATION (KR) 2023-03-23 US disclosed
EP-3976604-A1 1,3,4-OXADIAZOLE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2022-04-06 EP disclosed
CN-113924296-A 1,3, 4-oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions comprising the same 株式会社钟根堂 2022-01-11 CN disclosed
WO-2020240492-A1 1,3,4-OXADIAZOLE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2020-12-03 WO disclosed
WO-2020240492-A1 1,3,4-OXADIAZOLE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2020-12-03 WO 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-20230092890-A1 1, 3, 4-Oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same HDAC6, HDAC1, HDAC2 ALDH1A1 154/4885MAPT 974/4885MAPK1 1762/4885

“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.