SCHEMBL2969937

SCHEMBL2969937

CC(C)OC(=O)CCc1cc(C(=O)c2ccc(OC(C)C)cc2O)ccc1OC(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JUN P05412 3/20 0.43
FOS P01100 2/20 0.43
ALDH1A1 P00352 6/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
PGR P06401 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38
PDE4A P27815 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
HRH1 P35367 1/20 0.38
HTT P42858 1/20 0.38
SLC6A3 Q01959 1/20 0.38
PDE4D Q08499 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL2954382 0.91 JUN (0.43) JUNFOSALDH1A1MAPTHPGD
SCHEMBL2961268 0.91 FOS (0.44) JUNFOSALDH1A1MAPTMAPK1
SCHEMBL2960332 0.89 JUN (0.55) JUNFOSALDH1A1MAPTHPGD
SCHEMBL2962804 0.82 HPGD (0.42) JUNFOSALDH1A1HPGDLMNA
SCHEMBL2959153 0.81 JUN (0.54) JUNFOSALDH1A1MAPTHPGD
SCHEMBL2968397 0.81 FOS (0.51) JUNFOSALDH1A1MAPTHPGD
SCHEMBL2968731 0.80 JUN (0.70) JUNFOSALDH1A1MAPTHPGD
SCHEMBL2968525 0.80 ALDH1A1 (0.44) JUNFOSALDH1A1MAPTCA12
SCHEMBL27613406 0.80 HPGD (0.40) JUNFOSALDH1A1HPGDLMNA
SCHEMBL2967371 0.77 JUN (0.48) JUNFOSALDH1A1MAPTHPGD

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
EP-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
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
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 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-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SP1, AP1G1, JUN JUN 3/4885FOS 163/4885ALDH1A1 1493/4885

“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.