SCHEMBL7026421

SCHEMBL7026421

CCOC(=O)C(C)(Cc1cc2cc(OC)c(OC)cc2s1)c1ccc(C(=N)N)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 7/20 0.47
F12 P00748 1/20 0.43
F2 P00734 3/20 0.41
PRSS1 P07477 3/20 0.41
F10 P00742 2/20 0.41
PLG P00747 2/20 0.41
HTT P42858 1/20 0.36
CNR2 P34972 1/20 0.35
MAPK1 P28482 1/20 0.34
PLAU P00749 1/20 0.34
TMPRSS15 P98073 2/20 0.34

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
SCHEMBL7033189 0.84 STING1 (0.48) STING1CNR2
SCHEMBL7025757 0.83 STING1 (0.48) STING1CNR2
SCHEMBL7031570 0.80 STING1 (0.40) STING1F12MAPK1
SCHEMBL7032252 0.77 STING1 (0.42) STING1
SCHEMBL7025853 0.76 STING1 (0.41) STING1F12HTT
SCHEMBL7034684 0.76 STING1 (0.57) STING1CNR2
SCHEMBL7024555 0.76 ACHE (0.44) STING1F12
SCHEMBL7028941 0.75 STING1 (0.42) STING1
SCHEMBL7031077 0.75 STING1 (0.39) STING1F12
SCHEMBL7030439 0.75 STING1 (0.40) STING1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030109570-A1 Activate a peroxisome proliferator-activated receptor (PPAR) alpha or gamma which is an intranuclear transcription factor. The compound may be used as an active ingredient to give a drug for preventing or treating a variety of diseases MITSUI CHEMICALS, INC. (JP) 2003-06-12 US disclosed
EP-1284265-A1 BENZOTHIOPHENE DERIVATIVES AND MEDICINAL USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-02-19 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-20030109570-A1 Activate a peroxisome proliferator-activated receptor (PPAR) alpha or gamma which is an intranuclear transcription factor. The compound may be used as an active ingredient to give a drug for preventing or treating a variety of diseases PPARG, PPARA, PPARD STING1 878/4885F12 3906/4885F2 3039/4885

“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.