SCHEMBL20296395

SCHEMBL20296395

CC(C)OC1CN(c2nc3cc(C(N)=O)ccc3o2)C1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 2/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.40
▸ LMNA P02545 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HCRTR1 O43613 4/20 0.39
▸ HCRTR2 O43614 4/20 0.39
▸ SSTR5 P35346 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL18344208 0.82 — —
SCHEMBL20296780 0.82 HDAC6 (0.45) HDAC6HCRTR1HCRTR2
SCHEMBL20296520 0.80 MGLL (0.46) HDAC6LMNATSHR
SCHEMBL20296328 0.79 RAB9A (0.52) HDAC6LMNATSHR
SCHEMBL20296507 0.78 HDAC6 (0.48) HDAC6LMNATSHRHCRTR1HCRTR2
SCHEMBL28821900 0.77 HDAC6 (0.49) HDAC6
SCHEMBL29363952 0.77 MAPT (0.46) LMNATSHRHTTSMN1; SMN2
SCHEMBL20296686 0.76 HDAC6 (0.44) HDAC6HCRTR1HCRTR2
SCHEMBL20296248 0.76 KDM4E (0.51) HDAC6LMNATSHR
SCHEMBL28821901 0.76 HRH3 (0.48) HDAC6

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-20180179194-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2018-06-28 — — 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-20180179194-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB ACACB 1215/4885HDAC6 303/4885LMNA 2419/4885

“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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