SCHEMBL2961268

SCHEMBL2961268

CC(C)OC(=O)CCc1cc(C(=O)c2ccc(OC(C)C)cc2OC(C)C)ccc1OC(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOS P01100 2/20 0.44
JUN P05412 2/20 0.44
ELANE P08246 3/20 0.39
ALDH1A1 P00352 5/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 3/20 0.39
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
POLB P06746 1/20 0.38
PTGDR Q13258 2/20 0.36
PARP10 Q53GL7 1/20 0.36

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
SCHEMBL2969937 0.91 JUN (0.43) FOSJUNALDH1A1TSHRMAPT
SCHEMBL2954382 0.82 JUN (0.43) FOSJUNALDH1A1TSHRMAPT
SCHEMBL2968525 0.82 ALDH1A1 (0.44) FOSJUNALDH1A1TSHRMAPT
SCHEMBL2968551 0.81 FOS (0.55) FOSJUNELANEALDH1A1TSHR
SCHEMBL2960332 0.80 JUN (0.55) FOSJUNELANEALDH1A1MAPT
SCHEMBL29415001 0.77 NPC1 (0.57) ELANEALDH1A1TSHRMAPTMAPK1
SCHEMBL20496430 0.77 NPC1 (0.57) ELANEALDH1A1TSHRMAPTMAPK1
SCHEMBL29415030 0.73 ELANE (0.54) ELANEALDH1A1TSHRMAPTMAPK1
SCHEMBL20496451 0.73 ELANE (0.54) ELANEALDH1A1TSHRMAPTMAPK1
SCHEMBL4284195 0.73 FOS (0.64) FOSJUNALDH1A1TSHRMAPT

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 FOS 163/4885JUN 3/4885ELANE 804/4885

“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.