SCHEMBL2967726

SCHEMBL2967726

CCOC(=O)CCc1cc(C(=O)c2ccc(OC3CCCC3)cc2O)ccc1OCc1ccc(C(=O)NS(C)(=O)=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.56
UGT1A1 P22309 1/20 0.56
UGT1A3 P35503 1/20 0.56
UGT1A8 Q9HAW9 1/20 0.56
GRM2 Q14416 2/20 0.40
ADRB3 P13945 9/20 0.37
ADRB1 P08588 3/20 0.37
HPGD P15428 1/20 0.37
SCN9A Q15858 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL2963264 0.85 JUN (0.59) JUNUGT1A1UGT1A3UGT1A8HDAC1
SCHEMBL2962824 0.84 JUN (0.56) JUNUGT1A1UGT1A3UGT1A8ADRB3
SCHEMBL2966592 0.84 JUN (0.57) JUNUGT1A1UGT1A3UGT1A8HPGD
SCHEMBL2960177 0.83 JUN (0.56) JUNUGT1A1UGT1A3UGT1A8HPGD
SCHEMBL2956891 0.83 JUN (0.67) JUNUGT1A1UGT1A3UGT1A8HPGD
SCHEMBL6829363 0.82 JUN (0.60) JUNUGT1A1UGT1A3UGT1A8HPGD
SCHEMBL2967715 0.81 JUN (0.59) JUNUGT1A1UGT1A3UGT1A8
SCHEMBL2967720 0.81 JUN (0.59) JUNUGT1A1UGT1A3UGT1A8
SCHEMBL2963266 0.80 JUN (0.60) JUNUGT1A1UGT1A3UGT1A8HDAC1
SCHEMBL2970244 0.80 JUN (0.57) JUNUGT1A1UGT1A3UGT1A8

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-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SHUNICHI SHIOZAWA (JP) 2005-05-26 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-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SP1, AP1G1, JUN JUN 3/4885UGT1A1 1244/4885UGT1A3 2640/4885

“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.