SCHEMBL18308832

SCHEMBL18308832

COc1cc(-c2cc(OCCO)cc(OCCO)c2)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ AURKA O14965 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ AURKB Q96GD4 1/20 0.46
▸ CALM1 P0DP23 1/20 0.45
▸ FYN P06241 4/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ MAOB P27338 1/20 0.44

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
SCHEMBL18308837 0.84 KMO (0.41) MAPK1HSD17B10CYP3A4TSHRERN1
SCHEMBL1772657 0.83 MAOB (0.50) CALM1FYNMEN1LMNAGAA
SCHEMBL18311417 0.80 MCHR1 (0.47) MEN1LMNAGAAMAPTHPGD
SCHEMBL3693339 0.79 MAOB (0.67) ALOX5PTGS1PTGS2FYNMEN1
SCHEMBL4386820 0.77 MAOB (0.64) ALOX5PTGS1PTGS2FYNMEN1
SCHEMBL29260699 0.77 FYN (0.48) ALOX5PTGS1PTGS2AURKAKDR
Sulfuric Acid SCHEMBL11482267 0.77 PNLIP (0.47) ALOX5CALM1FYNMEN1GAA
SCHEMBL18411549 0.76 TSHR (0.50) MEN1LMNAMAPTHPGDMAPK1
SCHEMBL12477879 0.74 APP (0.61) ALOX5PTGS1PTGS2FYNMEN1
SCHEMBL18311383 0.74 ERN1 (0.50) ALOX5PTGS1PTGS2FYNPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11225606-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2022-01-18 — — US disclosed
US-20200248078-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2020-08-06 — — US disclosed
EP-3121247-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2019-10-02 — — EP disclosed
US-20190256777-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2019-08-22 — — US disclosed
US-10344215-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2019-07-09 — — US disclosed
EP-3121247-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2017-01-25 — — EP disclosed
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-12-15 — — US disclosed
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-12-15 — — 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 (5 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-11225606-B2 Polymerizable compounds and the use thereof in liquid-crystal displays VCL, PLEC, EML4 ALOX5 2243/4885PTGS1 4631/4885PTGS2 4649/4885
US-10344215-B2 Polymerizable compounds and the use thereof in liquid-crystal displays VCL, PLEC, EML4 ALOX5 2243/4885PTGS1 4631/4885PTGS2 4649/4885
US-20190256777-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 ALOX5 2243/4885PTGS1 4631/4885PTGS2 4649/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 ALOX5 2243/4885PTGS1 4631/4885PTGS2 4649/4885
US-20200248078-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 ALOX5 2243/4885PTGS1 4631/4885PTGS2 4649/4885

“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.

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