SCHEMBL18615296

SCHEMBL18615296

COc1cc(C2c3c(ccc4ccc(OC(=O)OC(C)(C)C)cc34)Oc3ccc4ccc(OC(=O)OC(C)(C)C)cc4c32)cc(I)c1O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
MTNR1A P48039 3/20 0.36
MTNR1B P49286 1/20 0.36
NPSR1 Q6W5P4 4/20 0.35
ELANE P08246 1/20 0.33
KDM1A O60341 1/20 0.33
CA2 P00918 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
SIRT5 Q9NXA8 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL18613100 0.95 MEN1 (0.36) MEN1GAAKMT2ANPSR1ELANE
SCHEMBL18615297 0.90 MEN1 (0.39) MEN1GAAKMT2AMTNR1AMTNR1B
SCHEMBL23587441 0.90 NPSR1 (0.37) MEN1KMT2AMTNR1ANPSR1ELANE
SCHEMBL23960175 0.86 NPSR1 (0.38) MEN1KMT2AMTNR1ANPSR1ELANE
SCHEMBL19961775 0.85 NFKB1 (0.35) MEN1GAAKMT2ANPSR1ELANE
SCHEMBL18613101 0.84 MEN1 (0.38) MEN1GAAKMT2ANPSR1ELANE
SCHEMBL18613172 0.81 MEN1 (0.39) MEN1GAAKMT2ANPSR1SIRT2
SCHEMBL21755771 0.81 NPSR1 (0.37) NPSR1ELANEKDM1ACA2SIRT2
SCHEMBL23587443 0.80 NPSR1 (0.37) MEN1GAAKMT2ANPSR1ELANE
SCHEMBL18615248 0.80 NPSR1 (0.42) MEN1KMT2ANPSR1ELANEKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11143962-B2 Material for forming underlayer film for lithography, composition for forming underlayer film for lithography, underlayer film for lithography and production method thereof, pattern forming method, resin, and purification method MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-10-12 US disclosed
US-20190041750-A1 MATERIAL FOR FORMING UNDERLAYER FILM FOR LITHOGRAPHY, COMPOSITION FOR FORMING UNDERLAYER FILM FOR LITHOGRAPHY, UNDERLAYER FILM FOR LITHOGRAPHY AND PRODUCTION METHOD THEREOF, PATTERN FORMING METHOD, RESIN, AND PURIFICATION METHOD MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-02-07 US disclosed
WO-2017038645-A1 MATERIAL FOR FORMING UNDERLAYER FILMS FOR LITHOGRAPHY, COMPOSITION FOR FORMING UNDERLAYER FILMS FOR LITHOGRAPHY, UNDERLAYER FILM FOR LITHOGRAPHY AND METHOD FOR PRODUCING SAME, PATTERN FORMING METHOD, RESIN, AND PURIFICATION METHOD 三菱瓦斯化学株式会社 2017-03-09 WO 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 (2 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-20190041750-A1 MATERIAL FOR FORMING UNDERLAYER FILM FOR LITHOGRAPHY, COMPOSITION FOR FORMING UNDERLAYER FILM FOR LITHOGRAPHY, UNDERLAYER FILM FOR LITHOGRAPHY AND PRODUCTION METHOD THEREOF, PATTERN FORMING METHOD, RESIN, AND PURIFICATION METHOD MLLT1, JMJD6, DOT1L MEN1 3359/4885GAA 4025/4885KMT2A 80/4885
US-11143962-B2 Material for forming underlayer film for lithography, composition for forming underlayer film for lithography, underlayer film for lithography and production method thereof, pattern forming method, resin, and purification method MLLT1, MLLT3, KDM2B MEN1 3160/4885GAA 3928/4885KMT2A 93/4885

“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.