SCHEMBL6861759

SCHEMBL6861759

C=CC(=O)OCC1CSC(c2ccc(-c3ccccc3)cc2)S1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.39
THRB P10828 1/20 0.37
GSK3B P49841 1/20 0.35
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
FFAR1 O14842 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
GSTO1 P78417 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
SCHEMBL6856182 0.93 THRB (0.40) MGLLTHRBGSK3B
SCHEMBL5208212 0.91 THRB (0.34) THRB
SCHEMBL6863277 0.88 THRB (0.41) THRBRAB9ASMN1; SMN2FFAR1
SCHEMBL6862965 0.85 GSK3B (0.32) THRBGSK3B
SCHEMBL6863500 0.85 MAPT (0.33) THRBGSK3BRAB9ANPC1
SCHEMBL6860887 0.85 MAPT (0.36) THRBGSK3B
SCHEMBL5211705 0.84 THRB (0.37) THRB
SCHEMBL6860926 0.84 THRB (0.36) THRBSMN1; SMN2SLC6A4
SCHEMBL5209268 0.84 THRB (0.38) THRB
SCHEMBL6856677 0.83 CA1 (0.36) GSK3BRAB9ASMN1; SMN2

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-6794471-B2 OF A HYDROXYHYDROCARBYL- OR MERCAPTOHYDROCARBYL- DITHIOLANE; CURED OPTICAL ARTICLE FORMED BY PHOTOPOLYMERIZING THE ACRYLATE MITSUI CHEMICALS, INC. (JP) 2004-09-21 US disclosed
EP-1193264-B1 Acrylic ester compound and usage thereof MITSUI CHEMICALS INC (JP) 2004-03-31 EP disclosed
US-20020061995-A1 Acrylic ester compound and usage thereof MITSUI CHEMICALS, INC. (JP) 2002-05-23 US disclosed
EP-1193264-A1 Acrylic ester compound and usage thereof Mitsui Chemicals, Inc. (JP) 2002-04-03 EP 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-20020061995-A1 Acrylic ester compound and usage thereof ASS1, HAT1, EIF2B1 MGLL 1389/4885THRB 3115/4885GSK3B 4815/4885

“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.