SCHEMBL4193243

SCHEMBL4193243

C=CCOC(=O)OCCN1CCN(CCOC(=O)OCC=C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL4200824 0.93 SCN9A (0.34) CYP3A4NPSR1TDP1
SCHEMBL4196055 0.91 NPSR1 (0.31) CYP3A4NPSR1TDP1
SCHEMBL4201430 0.82 POLB (0.42) ALDH1A1TSHR
SCHEMBL4194413 0.81 KDM4E (0.36) CYP3A4NPSR1ALDH1A1KDM4E
SCHEMBL4196309 0.78 TSHR (0.47) CYP3A4ALDH1A1KDM4ETSHRHSD17B10
SCHEMBL6864609 0.78 CYP3A4 (0.38) CYP3A4NPSR1MAPTCACNA1BAPBA1
SCHEMBL176184 0.74 CYP3A4 (0.43) CYP3A4NPSR1MAPTCACNA1BAPBA1
SCHEMBL4492708 0.74 SIGMAR1 (0.30)
SCHEMBL4195667 0.74 FAAH (0.35) NPSR1ALDH1A1
SCHEMBL11837071 0.73 TSHR (0.46) CYP3A4ALDH1A1TSHRHSD17B10

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
EP-1361246-B1 ORGANIC POLYMER AND NOVEL POLYMERIZABLE COMPOUND MITSUI CHEMICALS INC (JP) 2009-02-18 EP disclosed
US-6797805-B2 Organic polymers and novel polymerizable compounds MITSUI CHEMICALS, INC. (JP) 2004-09-28 US disclosed
EP-1361246-A1 ORGANIC POLYMER AND NOVEL POLYMERIZABLE COMPOUND Mitsui Chemicals, Inc. (JP) 2003-11-12 EP disclosed
US-20030166808-A1 Organic polymers and novel polymerizable compound MITSUI CHEMICALS, INC. (JP) 2003-09-04 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-20030166808-A1 Organic polymers and novel polymerizable compound PCNA, UTP18, ODC1 CYP3A4 3262/4885NPSR1 4727/4885MAPT 35/4885

“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.