SCHEMBL20747660

SCHEMBL20747660

CCC(C)(C)C(C)OC(=O)OCC(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
NFKB1 P19838 1/20 0.33
PTGS1 P23219 1/20 0.33
APEX1 P27695 1/20 0.33
THPO P40225 1/20 0.33
PMP22 Q01453 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
MMP8 P22894 1/20 0.31
PRKCA P17252 1/20 0.30

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
SCHEMBL20747769 0.86 TSHR (0.35) TSHRALDH1A1TDP1MEN1LMNA
SCHEMBL18067516 0.82 TSHR (0.41) TSHRALDH1A1TDP1MEN1LMNA
SCHEMBL20747675 0.80 MAPT (0.37) ALDH1A1MEN1LMNAKMT2AL3MBTL1
SCHEMBL28542622 0.79
SCHEMBL20747699 0.77 TSHR (0.32) TSHRALDH1A1LMNAL3MBTL1
SCHEMBL20747581 0.76 MAPT (0.33) TSHRALDH1A1MEN1LMNAKMT2A
SCHEMBL20747606 0.75 MAPT (0.35) TSHRALDH1A1MEN1LMNAKMT2A
SCHEMBL3116763 0.73 TSHR (0.46) TSHRALDH1A1TDP1MEN1LMNA
SCHEMBL31731225 0.73 TSHR (0.46) TSHRALDH1A1TDP1MEN1LMNA
SCHEMBL20747607 0.73 GRIN2D (0.36) LMNACYP3A4CYP2C9NFKB1PMP22

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-10208045-B2 Aza-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-02-19 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-10208045-B2 Aza-pyridone compounds and uses thereof PNPO, ITPA, PDXK TSHR 2479/4885ALDH1A1 1441/4885TDP1 1026/4885

“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.