SCHEMBL19842012

SCHEMBL19842012

CCOC(=O)C1CN(C)CCCCC1=O

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
ALDH1A1 P00352 8/20 0.43
CYP2D6 P10635 1/20 0.41
TLR4 O00206 1/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 2/20 0.39
HSD17B10 Q99714 2/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL3286457 0.89 MAPT (0.47) MAPTALDH1A1TLR4MEN1KMT2A
SCHEMBL19841984 0.82 ALDH1A1 (0.46) MAPTALDH1A1CYP2D6TLR4MEN1
SCHEMBL9830385 0.80 MAPT (0.49) MAPTALDH1A1TLR4MEN1KMT2A
SCHEMBL19841968 0.79 ALDH1A1 (0.46) MAPTALDH1A1CYP2D6TLR4MEN1
SCHEMBL23039821 0.78 MAPT (0.43) MAPTALDH1A1TLR4MEN1KMT2A
SCHEMBL2470785 0.78 TLR4 (0.51) MAPTALDH1A1CYP2D6TLR4MEN1
SCHEMBL276016 0.78 TLR4 (0.51) MAPTALDH1A1CYP2D6TLR4MEN1
SCHEMBL19841982 0.77 TLR4 (0.48) MAPTALDH1A1CYP2D6TLR4MEN1
SCHEMBL7733726 0.76 TLR4 (0.50) MAPTALDH1A1CYP2D6TLR4MEN1
SCHEMBL7392059 0.76 TLR4 (0.50) MAPTALDH1A1CYP2D6TLR4MEN1

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
US-20180201590-A1 AZOCANE AND AZONANE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2018-07-19 US disclosed
US-9884831-B2 Azocane and azonane derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2018-02-06 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-20180201590-A1 AZOCANE AND AZONANE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, HCCS, SLC10A1 MAPT 3576/4885ALDH1A1 2044/4885CYP2D6 826/4885

“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.