SCHEMBL4544744

SCHEMBL4544744

CCCCC(CC)COC(=O)C(=CC=CN(C)C)C(=O)OCC(CC)CCCC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.50
▸ CYP3A4 P08684 5/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ ATM Q13315 1/20 0.49
▸ ALDH1A1 P00352 7/20 0.47
▸ CA2 P00918 4/20 0.47
▸ LMNA P02545 3/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ PRSS1 P07477 1/20 0.45
▸ PRSS2 P07478 1/20 0.45
▸ PRSS3 P35030 1/20 0.45
▸ MAPK1 P28482 3/20 0.42
▸ RECQL P46063 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ MMP14 P50281 1/20 0.38
▸ CA1 P00915 1/20 0.33

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
SCHEMBL12758245 1.00 TSHR (0.50) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL12864660 0.96 TSHR (0.47) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL12293122 0.87 TSHR (0.48) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL12292855 0.84 ALDH1A1 (0.47) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL5272544 0.84 ALDH1A1 (0.47) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL13009322 0.81 TSHR (0.39) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL13399270 0.79 MAPT (0.36) ALDH1A1
SCHEMBL13855918 0.79 MAPT (0.36) ALDH1A1
SCHEMBL12864682 0.78 TSHR (0.38) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL19240032 0.78 ALDH1A1 (0.47) TSHRCYP3A4TDP1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178601-B2 Polymer film, polarizing plate protective film, polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-05-15 — — US disclosed
US-20090080074-A1 POLYMER FILM, POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2009-03-26 — — US disclosed
US-20080204644-A1 Liquid crystal display device FUJIFILM CORPORATION (JP) 2008-08-28 — — US disclosed
US-20080192192-A1 Optical film and polarizing plate FUJIFILM CORPORATION (JP) 2008-08-14 — — 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-20090080074-A1 POLYMER FILM, POLARIZING PLATE PROTECTIVE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE RPA3, RTF1, RPA1 TSHR 378/4885CYP3A4 3291/4885TDP1 597/4885

“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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