SCHEMBL16046208

SCHEMBL16046208

COc1ccc(C=O)c(OC(=O)O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.71
TRIM24 O15164 1/20 0.59
TYR P14679 1/20 0.59
TRIM33 Q9UPN9 1/20 0.59
ERN1 O75460 3/20 0.54
MAPT P10636 4/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP1A2 P05177 5/20 0.50
CYP1A1 P04798 4/20 0.50
CYP1B1 Q16678 4/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TNFRSF1A P19438 1/20 0.48
LMNA P02545 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HPGD P15428 1/20 0.47
LY96 Q9Y6Y9 1/20 0.46

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
SCHEMBL16045979 0.88 ALDH1A1 (0.59) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL16111393 0.88 ALDH1A1 (0.73) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL29136541 0.86 ALDH1A1 (0.71) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL9055047 0.86 ALDH1A1 (0.71) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL96291 0.83 ALDH1A1 (1.00) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL27584637 0.83 ALDH1A1 (0.61) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL8356166 0.82 ALDH1A1 (0.75) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL6131805 0.82 ALDH1A1 (0.65) ALDH1A1TRIM24TYRTRIM33ERN1
Hydrochloric Acid SCHEMBL9456784 0.82 ALDH1A1 (0.96) ALDH1A1TRIM24TYRTRIM33ERN1
SCHEMBL13168673 0.81 ALDH1A1 (0.69) ALDH1A1TRIM24TYRTRIM33ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9920029-B2 Isatin compounds, compositions and methods for treatment of degenerative diseases and disorders MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2018-03-20 US disclosed
EP-2970183-A2 ISATIN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS Musc Foundation for Research Development (US) 2016-01-20 EP disclosed
US-20150218128-A1 Isatin Compounds, Compositions And Methods For Treatment Of Degenerative Diseases And Disorders MUSC Foundation for Research Development (10 pp.) 2015-08-06 US disclosed
US-9079853-B2 Isatin compounds, compositions and methods for treatment of degenerative diseases and disorders MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2015-07-14 US disclosed
WO-2014160143-A2 ISATIN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-10-02 WO disclosed
US-20140275075-A1 ISATIN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-09-18 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 (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-20150218128-A1 Isatin Compounds, Compositions And Methods For Treatment Of Degenerative Diseases And Disorders CLN6, AREG, HASPIN ALDH1A1 751/4885TRIM24 3939/4885TYR 1019/4885
US-20140275075-A1 ISATIN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS CLN6, AREG, HASPIN ALDH1A1 751/4885TRIM24 3939/4885TYR 1019/4885

“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.