SCHEMBL13464005

SCHEMBL13464005

CCCC(C)CCCC1CCC(OC)CC1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.50
▸ CYP1A2 P05177 1/20 0.34
▸ DAO P14920 1/20 0.33
▸ LMNA P02545 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ NAAA Q02083 1/20 0.30

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
SCHEMBL16809920 0.91 MAPT (0.43) MAPT
SCHEMBL19262493 0.83 MAPT (0.48) MAPTCYP1A2
SCHEMBL4957551 0.83 MAPT (0.43) MAPTDAO
SCHEMBL20932920 0.82 TSHR (0.33) MAPTDAO
SCHEMBL15728707 0.81 MAPT (0.36) MAPTCYP1A2DAO
SCHEMBL15457901 0.80 MAPT (0.54) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL13082034 0.79 CYP1A2 (0.54) MAPTCYP1A2DAOLMNAMAPK1
SCHEMBL8570161 0.79 CYP1A2 (0.54) MAPTCYP1A2DAOLMNAMAPK1
SCHEMBL4960222 0.79 LMNA (0.39) MAPTCYP1A2DAOLMNAMAPK1
SCHEMBL15368083 0.79 MAPT (0.57) MAPTCYP1A2LMNAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017178419-A1 COMPOSITION FOR NANOENCAPSULATION AND NANOCAPSULES COMPRISING A LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-10-19 — — WO disclosed
US-20170292072-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2017-10-12 — — US disclosed
US-20170002267-A1 Liquid Crystal Medium MERCK PATENT GMBH (DE) 2017-01-05 — — US disclosed
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-12-15 — — US disclosed
US-20160333270-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-11-17 — — US disclosed
US-9388339-B2 Liquid-crystalline medium, method for the stabilization thereof, and liquid-crystal display MERCK PATENT GMBH (DE) 2016-07-12 — — US disclosed
US-20160108318-A1 LIQUID CRYSTALLINE MEDIUM AND LIQUID CRYSTAL DEVICE MERCK PATENT GMBH (DE) 2016-04-21 — — US disclosed
US-20160046863-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-02-18 — — US disclosed
US-20160046862-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-02-18 — — US disclosed
US-20150301368-A1 Liquid-crystal displays and liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2015-10-22 — — US disclosed
US-20150267119-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2015-09-24 — — US disclosed
US-20150203758-A1 LIQUID-CRYSTALLINE MEDIA MERCK PATENT GMBH (DE) 2015-07-23 — — US disclosed
US-20150175884-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-06-25 — — US disclosed
US-8999460-B2 Compounds and liquid-crystalline medium MERCK PATENT GMBH (DE) 2015-04-07 — — US disclosed
US-8962102-B2 — — 2015-02-24 — — US disclosed
US-20140111730-A1 Liquid-crystalline medium, method for the stabilization thereof, and liquid-crystal display MERCK PATENT GMBH (DE) 2014-04-24 — — US disclosed
US-20140028964-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-01-30 — — US disclosed
EP-1646703-B1 LIQUID-CRYSTAL MEDIUM CONTAINING MONOFLUOROTERPHENYL COMPOUNDS MERCK PATENT GMBH (DE) 2010-03-17 — — 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 (3 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-20150301368-A1 Liquid-crystal displays and liquid-crystalline media having homeotropic alignment LASP1, VCL, NEFM MAPT 202/4885CYP1A2 4329/4885DAO 1144/4885
US-20150267119-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS LPXN, VCL, LCP1 MAPT 19/4885CYP1A2 3440/4885DAO 2563/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 MAPT 40/4885CYP1A2 3876/4885DAO 2030/4885

“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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