SCHEMBL29504306

SCHEMBL29504306

CN(C)CCNc1ccccc1[N+](=O)[O-]

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.65
NPSR1 Q6W5P4 1/20 0.65
KAT2B Q92831 2/20 0.60
MAPT P10636 5/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
HTT P42858 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.50
LMNA P02545 2/20 0.50
MAPK1 P28482 2/20 0.50
GAA P10253 1/20 0.49
CASP7 P55210 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL972656 1.00 ALDH1A1 (0.65) ALDH1A1NPSR1KAT2BMAPTSMN1; SMN2
SCHEMBL7973853 0.91 KAT2B (0.66) ALDH1A1NPSR1KAT2BMAPTSMN1; SMN2
SCHEMBL14960116 0.86 KAT2B (0.59) ALDH1A1NPSR1KAT2BMAPTSMN1; SMN2
SCHEMBL16655113 0.85 KAT2B (0.57) ALDH1A1NPSR1KAT2BMAPTSMN1; SMN2
SCHEMBL8985609 0.84 KAT2B (0.57) ALDH1A1NPSR1KAT2BMAPTSMN1; SMN2
SCHEMBL6198859 0.84 KAT2B (0.80) ALDH1A1KAT2BMAPTSMN1; SMN2NPC1
SCHEMBL4077151 0.81 KAT2B (0.66) ALDH1A1KAT2BMAPTSMN1; SMN2NPC1
SCHEMBL7170020 0.81 KAT2B (0.81) ALDH1A1KAT2BMAPTSMN1; SMN2NPC1
SCHEMBL6200169 0.81 KAT2B (0.81) ALDH1A1KAT2BMAPTSMN1; SMN2NPC1
SCHEMBL9725410 0.80 ALDH1A1 (0.72) ALDH1A1NPSR1KAT2BMAPTSMN1; SMN2

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
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

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 154/4885NPSR1 3462/4885KAT2B 22/4885

“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.