SCHEMBL21715106

SCHEMBL21715106

CCOC(=O)C(Cc1ccc(C)cc1)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.81

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.71
▸ ALDH1A1 P00352 6/20 0.58
▸ GAA P10253 2/20 0.58
▸ POLB P06746 3/20 0.57
▸ MAPT P10636 5/20 0.57
▸ KMT2A Q03164 4/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ PKM P14618 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ STAT3 P40763 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL9631343 0.91 HSD11B1 (0.60) HSD11B1ALDH1A1GAAPOLBMAPT
Hydrochloric Acid SCHEMBL9630160 0.90 HSD11B1 (0.59) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL21501052 0.89 HSD11B1 (0.67) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL11026630 0.84 ALDH1A1 (0.54) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL20246861 0.84 ALDH1A1 (0.82) HSD11B1ALDH1A1GAAPOLBKMT2A
SCHEMBL11778138 0.84 ALDH1A1 (0.55) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL8064549 0.84 ALDH1A1 (0.55) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL28763753 0.81 HSD11B1 (0.51) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL11539935 0.81 ALDH1A1 (0.53) HSD11B1ALDH1A1GAAPOLBMAPT
SCHEMBL8283042 0.81 HSD11B1 (0.49) HSD11B1ALDH1A1GAAPOLBMAPT

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
US-10696617-B2 Method for alcoholysis of amide ASYMCHEM LABORATORIES (TIANJIN) CO., LTD (CN) 2020-06-30 — — US disclosed
US-20200055807-A1 METHOD FOR ALCOHOLYSIS OF AMIDE ASYMCHEM LABORATORIES (TIANJIN) CO., LTD (CN) 2020-02-20 — — US disclosed
CN-107417594-A A kind of method of acid amides alcoholysis 凯莱英医药集团(天津)股份有限公司 2017-12-01 — — CN 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 (2 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-20200055807-A1 METHOD FOR ALCOHOLYSIS OF AMIDE ADH1A, ADH5, ADH1C HSD11B1 779/4885ALDH1A1 43/4885GAA 820/4885
US-10696617-B2 Method for alcoholysis of amide ADH5, ADH1A, ADH1C HSD11B1 766/4885ALDH1A1 91/4885GAA 1107/4885

“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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