SCHEMBL18806033

SCHEMBL18806033

C=C(C)C(=O)OCCOC(c1ccc(-c2ccc(OC(=O)C(=C)C)cc2)cc1)C(C)(C)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 3/20 0.39
▸ POLB P06746 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ KMT2A Q03164 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ THRB P10828 1/20 0.35
▸ ACACB O00763 3/20 0.32
▸ ACACA Q13085 3/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ TSHR P16473 3/20 0.31
▸ HSD17B10 Q99714 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
SCHEMBL18808069 0.91 POLB (0.38) POLBAPEX1HTTTDP1KMT2A
SCHEMBL21231952 0.86 ELANE (0.40) ELANEKMT2AATMACACBACACA
SCHEMBL21675417 0.83 ELANE (0.42) ELANEPOLBAPEX1HTTTDP1
SCHEMBL18806035 0.83 ELANE (0.38) ELANEPOLBAPEX1HTTTDP1
SCHEMBL20172055 0.83 ELANE (0.43) ELANEKMT2AATMACACBACACA
SCHEMBL18806020 0.83 ELANE (0.43) ELANEKMT2AATMACACBACACA
SCHEMBL25570265 0.82 ELANE (0.37) ELANEPOLBAPEX1HTTTDP1
SCHEMBL20172066 0.80 ELANE (0.38) ELANEPOLBTDP1KMT2AATM
SCHEMBL23255224 0.80 ELANE (0.43) ELANEKMT2AATMACACBACACA
SCHEMBL25570168 0.80 ELANE (0.41) ELANEKMT2AATMACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023208801-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-11-02 — — WO disclosed
US-20230183571-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-06-15 — — US disclosed
US-20230183571-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-06-15 — — US disclosed
EP-4194529-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS Merck Patent GmbH (DE) 2023-06-14 — — EP disclosed
US-11312909-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2022-04-26 — — US disclosed
EP-3162875-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2018-05-23 — — EP disclosed
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS GMBH, MERCK PATENT (DE) 2017-05-04 — — US disclosed
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS GMBH, MERCK PATENT (DE) 2017-05-04 — — US disclosed
EP-3162875-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2017-05-03 — — 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 (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-11312909-B2 Polymerizable compounds and the use thereof in liquid-crystal displays VCL, LCP1, MAP1LC3C ELANE 766/4885POLB 3739/4885APEX1 3526/4885
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, LCP1, MAP1LC3C ELANE 719/4885POLB 3879/4885APEX1 3407/4885

“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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