SCHEMBL7528735

SCHEMBL7528735

CC(CCC(C)C(O)=S)C(O)=S

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.39
CYP1A2 P05177 1/20 0.39
BLM P54132 1/20 0.33
ACE2 Q9BYF1 1/20 0.31
LTA4H P09960 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
SCHEMBL7798009 0.84
SCHEMBL874480 0.84
SCHEMBL9416691 0.82
Ammonia Solution, Strong SCHEMBL8650328 0.82
SCHEMBL2462623 0.82
SCHEMBL7509598 0.80
SCHEMBL874008 0.80
SCHEMBL7712170 0.79
SCHEMBL9245483 0.78 CA1 (0.52) ACE2
SCHEMBL21177127 0.78 TSHR (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6369269-B2 Thiol and sulfur-containing O-(meth)acrylate compounds and use thereof MITSUI CHEMICALS, INC. (JP) 2002-04-09 US disclosed
EP-0713105-B1 Composition for optical materials and use thereof MITSUI CHEMICALS INC (JP) 2002-03-13 EP disclosed
US-20010044555-A1 Thiol and sulfur-containing O-(meth)acrylate counpounds and use thereof KOBAYASHI SEIICHI (JP) 2001-11-22 US disclosed
US-6265510-B1 OPTICS; LENSES MITSUI CHEMICALS, INC. (JP) 2001-07-24 US disclosed
EP-0810210-B1 Thiol and sulfur-containing o-(meth)acrylate compounds and use thereof MITSUI CHEMICALS INC (JP) 2001-01-10 EP disclosed
US-6114485-A STARTING MATERIAL FOR A RESIN COMPOSITION USED IN OPTICAL APPLICATIONS SUCH AS A LENS MITSUI CHEMICALS, INC. (JP) 2000-09-05 US disclosed
US-5916987-A OPTICAL RESIN; LENSES MITSUI CHEMICALS, INC. (JP) 1999-06-29 US disclosed
US-5756766-A Composition for optical materials and use thereof MITSUI TOATSU CHEMICALS, INC. (JP) 1998-05-26 US disclosed
EP-0810210-A2 Thiol and sulfur-containing o-(meth)acrylate compounds and use thereof MITSUI TOATSU CHEMICALS, INC. (JP) 1997-12-03 EP disclosed
US-5652321-A Composition for optical materials and use thereof MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-29 US disclosed
EP-0713105-A2 Composition for optical materials and use thereof MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-05-22 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-20010044555-A1 Thiol and sulfur-containing O-(meth)acrylate counpounds and use thereof MSRB3, BHMT2, HBS1L GABRR1 719/4885CYP1A2 3178/4885BLM 231/4885

“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.