SCHEMBL6861257

SCHEMBL6861257

COc1ccc(C2SCC(CSCCS)S2)cc1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
MAOA P21397 2/20 0.33
KMT2A Q03164 2/20 0.32
KDM1A O60341 2/20 0.32
MAOB P27338 1/20 0.32
IDO1 P14902 1/20 0.32
HTR2C P28335 1/20 0.31
GAA P10253 2/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
MAP2K1 Q02750 1/20 0.30
CRBN Q96SW2 1/20 0.30
MEN1 O00255 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
SCHEMBL6860783 0.87 POLB (0.33) PTGS1PTGS2MAOAKMT2AKDM1A
SCHEMBL6856188 0.79 GSK3B (0.34) PTGS1PTGS2KMT2AGAAPOLB
SCHEMBL6863283 0.79 GAA (0.35) PTGS1PTGS2GAAPOLBRAB9A
SCHEMBL6861913 0.78 GAA (0.34) KMT2AGAAPOLBRAB9A
SCHEMBL6862891 0.78 CA1 (0.33) PTGS1PTGS2KMT2AGAAPOLB
SCHEMBL9607650 0.76 HTR2C (0.46) PTGS1PTGS2MAOAKMT2AKDM1A
SCHEMBL6862954 0.76 PTGS1 (0.41) PTGS1PTGS2MAOAKMT2AKDM1A
SCHEMBL6864166 0.73 GAA (0.36) PTGS1PTGS2KMT2AGAAPOLB
SCHEMBL6856418 0.73 GAA (0.38) PTGS1PTGS2KMT2AGAAPOLB
SCHEMBL6862798 0.71

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 PTGS1 303/4885PTGS2 1099/4885MAOA 2313/4885

“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.