SCHEMBL17050313

SCHEMBL17050313

CCCC1(CC2(CC3(CCC(=O)OC)c4ccccc4-c4ccccc43)COC2)c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.42
MAPT P10636 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ITGA4 P13612 1/20 0.38
PDK2 Q15119 3/20 0.34
PTPRC P08575 2/20 0.33
PTPN13 Q12923 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PGR P06401 2/20 0.33
BACE1 P56817 1/20 0.32
ESRRB O95718 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL15691712 0.95 APEX1 (0.46) APEX1MAPTALDH1A1ITGA4PDK2
SCHEMBL17050261 0.88 APEX1 (0.50) APEX1MAPTALDH1A1ITGA4PDK2
SCHEMBL17050358 0.86 APEX1 (0.49) APEX1MAPTALDH1A1ITGA4PDK2
SCHEMBL15691738 0.86 APEX1 (0.43) APEX1MAPTALDH1A1PDK2MEN1
SCHEMBL17050188 0.85 PGR (0.38) APEX1PDK2PGR
SCHEMBL17050352 0.84 APEX1 (0.55) APEX1MAPTALDH1A1ITGA4PDK2
SCHEMBL17050258 0.84 APEX1 (0.55) APEX1MAPTALDH1A1ITGA4PDK2
SCHEMBL17050314 0.83 CYP2C19 (0.40) APEX1ALDH1A1PDK2MEN1KMT2A
SCHEMBL17050345 0.83 ALDH1A1 (0.37) APEX1MAPTALDH1A1ITGA4PDK2
SCHEMBL15691716 0.83 MAPT (0.42) APEX1MAPTALDH1A1ITGA4PDK2

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 3376/4885MAPT 1376/4885ALDH1A1 3155/4885

“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.