SCHEMBL12242603

SCHEMBL12242603

C=CC(=O)Oc1ccc(C(F)(F)Oc2ccc(OC(F)(F)c3ccc(OC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 3/20 0.46
▸ KIF11 P52732 1/20 0.40
▸ TEAD1 P28347 2/20 0.39
▸ TGM2 P21980 1/20 0.37
▸ TRPV1 Q8NER1 3/20 0.36
▸ EPHX2 P34913 1/20 0.35
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ PRSS1 P07477 1/20 0.33
▸ ACR P10323 1/20 0.33
▸ MAOB P27338 2/20 0.33
▸ PDE6D O43924 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL18118993 0.95 KIF11 (0.47) THRBKIF11TEAD1TGM2TRPV1
SCHEMBL16978248 0.95 KIF11 (0.47) THRBKIF11TEAD1TGM2TRPV1
SCHEMBL12242612 0.92 THRB (0.43) THRBKIF11TEAD1TGM2CYP11B1
SCHEMBL25695944 0.87 ELANE (0.49) THRBKIF11TEAD1TRPV1EPHX2
SCHEMBL12242609 0.84 THRB (0.40) THRBKIF11TEAD1TGM2EPHX2
SCHEMBL12242605 0.84 PPARD (0.43) THRBKMT2A
SCHEMBL12085342 0.84 KIF11 (0.56) THRBKIF11TEAD1TGM2TRPV1
SCHEMBL28186415 0.84 EPHX2 (0.50) THRBTEAD1TRPV1EPHX2KMT2A
SCHEMBL12242607 0.84 THRB (0.42) THRBKIF11CYP11B1CYP11B2MAOB
SCHEMBL12242623 0.84 THRB (0.42) THRBKIF11TEAD1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9347000-B2 Polymerisable compounds and the use thereof in liquid-crystal media and liquid-crystal displays MERCK PATENT GMBH (DE) 2016-05-24 — — US disclosed
US-20140362334-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL MEDIA AND LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-12-11 — — US disclosed
US-8895117-B2 Polymerisable compounds and the use thereof in liquid-crystal media and liquid-crystal displays MERCK PATENT GMBH (DE) 2014-11-25 — — US disclosed
US-20110261311-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL MEDIA AND LIQUID-CRYSTAL DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-10-27 — — 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-20140362334-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL MEDIA AND LIQUID-CRYSTAL DISPLAYS LPXN, MAP1LC3C, VCL THRB 4838/4885KIF11 80/4885TEAD1 2686/4885
US-20110261311-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL MEDIA AND LIQUID-CRYSTAL DISPLAYS LPXN, MAP1LC3C, VCL THRB 4838/4885KIF11 80/4885TEAD1 2686/4885

“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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