SCHEMBL17051306

SCHEMBL17051306

CCOC(=O)CC1(CCC2(CC(=O)OCC)c3ccccc3-c3ccccc32)c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.47
ALDH1A1 P00352 4/20 0.44
PDK2 Q15119 4/20 0.43
TSHR P16473 1/20 0.41
CYP1A2 P05177 2/20 0.40
PPID Q08752 1/20 0.40
CA12 O43570 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
TDP2 O95551 3/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.39
APAF1 O14727 1/20 0.39

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
SCHEMBL17050350 0.94 APEX1 (0.46) APEX1ALDH1A1PDK2TSHRCYP1A2
SCHEMBL24981178 0.90 ALDH1A1 (0.44) APEX1ALDH1A1PDK2TSHRCYP1A2
SCHEMBL10009774 0.86 APEX1 (0.58) APEX1ALDH1A1PDK2TSHRCYP1A2
SCHEMBL10009363 0.84 APEX1 (0.60) APEX1ALDH1A1PDK2TSHRCYP1A2
SCHEMBL18674488 0.83 PDK2 (0.40) APEX1ALDH1A1PDK2CYP1A2TDP2
SCHEMBL9370516 0.82 KCNQ2 (0.54) ALDH1A1PDK2TSHRCYP1A2PPID
SCHEMBL17236541 0.82 PDK2 (0.43) APEX1ALDH1A1PDK2CYP1A2TDP2
SCHEMBL10008969 0.81 APEX1 (0.53) APEX1ALDH1A1PDK2TSHRCYP1A2
SCHEMBL10298039 0.81 APEX1 (0.53) APEX1ALDH1A1PDK2CYP1A2PPID
Hydrochloric Acid SCHEMBL8127736 0.81 KCNQ2 (0.52) ALDH1A1PDK2TSHRCYP1A2PPID

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-9518150-B2 Resin composition, stretched film, circularly polarizing plate, and image display device MITSUBISHI CHEMICAL CORPORATION (JP) 2016-12-13 US disclosed
US-20150247002-A1 RESIN COMPOSITION, STRETCHED FILM, CIRCULARLY POLARIZING PLATE, AND IMAGE DISPLAY DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2015-09-03 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-20150247002-A1 RESIN COMPOSITION, STRETCHED FILM, CIRCULARLY POLARIZING PLATE, AND IMAGE DISPLAY DEVICE RAD50, RAD54L, PUF60 APEX1 3376/4885ALDH1A1 3155/4885PDK2 4636/4885

“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.