SCHEMBL399635

SCHEMBL399635

C[Si](C)(C)O[Si](CCCc1ccccc1O)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MPO P05164 6/20 0.44
SLC6A4 P31645 2/20 0.44
TAAR1 Q96RJ0 1/20 0.43
IDO1 P14902 2/20 0.42
MGLL Q99685 1/20 0.41
HTR1A P08908 1/20 0.40
HSPA5 P11021 1/20 0.39
HRH3 Q9Y5N1 1/20 0.37
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
HIF1A Q16665 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL12574831 0.87 MPO (0.44) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL6684267 0.83 MPO (0.46) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL4465343 0.83 MPO (0.48) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL8611487 0.81 MPO (0.40) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL12713548 0.81 MPO (0.40) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL13524760 0.81 MPO (0.40) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL10025598 0.81 MPO (0.40) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL17753758 0.81 MPO (0.40) MPOSLC6A4TAAR1IDO1MGLL
SCHEMBL10427665 0.80 MPO (0.50) MPOSLC6A4TAAR1MGLLHTR1A
SCHEMBL4745370 0.80 MPO (0.44) MPOSLC6A4TAAR1IDO1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101701-B2 having a hydrophilic group and a silicon-containing alkyl group within molecule; lenses with high oxygen permeability independent from the water content may be obtained, wherein the fumaric acid derivatives is superior in compatibility with the hydrophilic monomer used in combination MENICON NECT CO., LTD. (JP) 2012-01-24 US disclosed
EP-1930338-A1 Fumaric acid derivates and ophtalmic lenses using the same E-brain Corporation Ltd. (JP) 2008-06-11 EP disclosed
US-20080132666-A1 Fumaric Acid Derivatives and Ophthalmic Lenses Using the Same MENICON NECT CO., LTD. (JP) 2008-06-05 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-20080132666-A1 Fumaric Acid Derivatives and Ophthalmic Lenses Using the Same FAH, FH, AQP4 MPO 3998/4885SLC6A4 3956/4885TAAR1 4392/4885

“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.