SCHEMBL20445035

SCHEMBL20445035

CC1CCN(CC(C)(C)C)CC(C)C1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.35
HRH4 Q9H3N8 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ACHE P22303 3/20 0.34
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT1 Q99873 1/20 0.34
PRMT8 Q9NR22 1/20 0.34
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
ALPG P10696 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
MAOB P27338 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
SCHEMBL12025014 0.90 ACHE (0.38) HRH3KDM4EACHECARM1PRMT6
SCHEMBL15096958 0.90 ACHE (0.38) HRH3KDM4EACHECARM1PRMT6
SCHEMBL12665785 0.85 KDM4E (0.42) HRH3HRH4KDM4ELMNARAB9A
SCHEMBL13656265 0.85 KDM4E (0.42) HRH3HRH4KDM4ELMNARAB9A
SCHEMBL9278459 0.81 ACHE (0.45) HRH3ACHECARM1PRMT6PRMT1
SCHEMBL15164245 0.78 KDM4E (0.47) HRH3KDM4ELMNAMAOB
SCHEMBL10159852 0.75 KDM4E (0.34) HRH3HRH4KDM4EALPG
SCHEMBL12385800 0.73 KDM4E (0.36) HRH3KDM4EACHECARM1PRMT6
SCHEMBL22544216 0.73 KDM4E (0.36) HRH3KDM4EACHECARM1PRMT6
SCHEMBL26817743 0.73 ACHE (0.35) HRH3KDM4EACHECARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180215743-A1 1,3,4-OXADIAZOLE AMIDE DERIVATIVE COMPOUND AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-08-02 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-20180215743-A1 1,3,4-OXADIAZOLE AMIDE DERIVATIVE COMPOUND AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME HDAC1, HDAC6, HDAC2 HRH3 651/4885HRH4 746/4885KDM4E 795/4885

“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.