SCHEMBL17346753

SCHEMBL17346753

Cc1ccc(NC(=O)OCC2CCCCC2)cc1NC(=O)OCC1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.55
ALDH1A1 P00352 4/20 0.53
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.53
LDLR P01130 8/20 0.52
HDAC3 O15379 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
NLRP3 Q96P20 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 1/20 0.44
TSHR P16473 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL13976141 0.84 ALDH1A1 (0.48) MGLLALDH1A1LMNAMAPK1LDLR
SCHEMBL13966760 0.84 ALDH1A1 (0.48) MGLLALDH1A1LMNAMAPK1LDLR
SCHEMBL21675994 0.84 ALDH1A1 (0.48) MGLLALDH1A1LMNAMAPK1LDLR
SCHEMBL10192097 0.82 MGLL (0.63) MGLLALDH1A1LMNAMAPK1L3MBTL1
SCHEMBL17344408 0.81 MGLL (0.73) MGLLALDH1A1HDAC3HDAC1HDAC2
SCHEMBL1841204 0.80 NPC1 (0.64) MGLLALDH1A1LMNAMAPK1LDLR
SCHEMBL473082 0.79 NLRP3 (0.66) ALDH1A1LMNAMAPK1NLRP3NPC1
SCHEMBL11419125 0.79 LMNA (0.57) ALDH1A1LMNAMAPK1NLRP3NPC1
SCHEMBL12407168 0.78 PTGIR (0.53) MGLLALDH1A1LMNANPC1TSHR
SCHEMBL4966292 0.77 NPC1 (0.64) MGLLALDH1A1LMNAL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10338290-B2 Cellulose ester film, polarizing plate, and liquid crystal display device FUJIFILM CORPORATION (JP) 2019-07-02 US disclosed
US-10040754-B2 Cellulose acylate film, novel compound, polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2018-08-07 US disclosed
US-20160370522-A1 CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-12-22 US disclosed
US-20160060405-A1 POLYMER FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-03-03 US disclosed
US-20150361036-A1 CELLULOSE ACYLATE FILM, NOVEL COMPOUND, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2015-12-17 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-10040754-B2 Cellulose acylate film, novel compound, polarizing plate and liquid crystal display device NR1D1, NR1H2, NR1D2 MGLL 329/4885ALDH1A1 3058/4885LMNA 1344/4885
US-20150361036-A1 CELLULOSE ACYLATE FILM, NOVEL COMPOUND, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE NR1D1, NR1H2, NR1D2 MGLL 329/4885ALDH1A1 3058/4885LMNA 1344/4885

“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.