SCHEMBL20052523

SCHEMBL20052523

C=COc1ccc(C2CCCCC2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.37
PTGDR Q13258 4/20 0.34
FEN1 P39748 9/20 0.33
ALOX5AP P20292 5/20 0.33
CEL P19835 1/20 0.32
PTGER2 P43116 1/20 0.31

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
SCHEMBL19986379 0.94 FEN1 (0.35) PTGDR2PTGDRFEN1ALOX5AP
SCHEMBL19986360 0.91 PTGDR2 (0.32) PTGDR2
SCHEMBL15233512 0.84
SCHEMBL172160 0.84 ESR2 (0.31)
SCHEMBL15684612 0.81 PTGDR2 (0.35) PTGDR2PTGDRFEN1ALOX5APCEL
SCHEMBL19985267 0.81
SCHEMBL20052525 0.80 HTR2C (0.41) PTGDR2PTGDR
SCHEMBL19985586 0.80
SCHEMBL10017841 0.79 CYP2C9 (0.35)
SCHEMBL27952428 0.78 CEL (0.44) PTGDR2FEN1ALOX5APCEL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873438-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-01-16 US disclosed
US-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-08-08 US disclosed
US-20230242817-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POYLMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-08-03 US disclosed
US-20210348056-A1 Polymerisable Compounds and the Use thereof in Liquid-Crystal Displays MERCK PATENT GMBH (DE) 2021-11-11 US disclosed
US-11072742-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2021-07-27 US disclosed
US-11008515-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2021-05-18 US disclosed
US-20210139781-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2021-05-13 US disclosed
US-10934487-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2021-03-02 US disclosed
US-20200291298-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-09-17 US disclosed
US-10759996-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2020-09-01 US disclosed
US-10676671-B2 Method of reducing ODF mura in polymer stabilised liquid crystal displays MERCK PATENT GMBH (DE) 2020-06-09 US disclosed
US-10642104-B2 Method of controlling the pretilt angle in polymer stabilised liquid crystal displays MERCK PATENT GMBH (DE) 2020-05-05 US disclosed
US-20190185754-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-06-20 US disclosed
US-20190161679-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-05-30 US disclosed
US-20180201837-A1 Method of Reducing ODF Mura in Polymer Stabilised Liquid Crystal Displays MERCK PATENT GMBH (DE) 2018-07-19 US disclosed
US-9944416-B2 Filling device and use thereof for dispensing a fluid MERCK PATENT GMBH (DE) 2018-04-17 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 (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-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays VCL, ILK, LCP1 PTGDR2 2714/4885PTGDR 2916/4885FEN1 3541/4885
US-20210139781-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, ILK, LCP1 PTGDR2 2714/4885PTGDR 2916/4885FEN1 3541/4885

“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.