SCHEMBL12090887

SCHEMBL12090887

C=CC(=O)OCCCCCCc1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(CCCCCCOC(=O)C=C)cc3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 7/20 0.53
▸ TSHR P16473 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ F2 P00734 1/20 0.46
▸ KMT2A Q03164 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ HPGD P15428 2/20 0.40
▸ ELANE P08246 1/20 0.40
▸ THRA P10827 4/20 0.40
▸ FKBP1A P62942 2/20 0.39
▸ NAAA Q02083 2/20 0.39
▸ MEN1 O00255 1/20 0.36
▸ TP53 P04637 2/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL13089473 1.00 THRB (0.53) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL13089464 1.00 THRB (0.53) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL17279031 1.00 THRB (0.53) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL19958229 0.96 THRB (0.50) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL19844482 0.96 THRB (0.50) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL12087298 0.95 THRB (0.52) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL1071618 0.94 THRB (0.64) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL22451086 0.94 THRB (0.64) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL1073240 0.94 THRB (0.64) THRBTSHRALDH1A1CYP3A4F2
SCHEMBL13089465 0.94 THRB (0.64) THRBTSHRALDH1A1CYP3A4F2

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303926-A1 LIQUID CRYSTAL COMPOSITION, LIGHT ABSORPTION ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-09-28 — — US disclosed
EP-4039776-A2 POLYMERISABLE LC MATERIAL AND POLYMER FILM Merck Patent GmbH (DE) 2022-08-10 — — EP disclosed
US-20220162505-A1 Polymerizable LC Material and Polymer Film MERCK PATENT GMBH (DE) 2022-05-26 — — US disclosed
US-11248171-B2 Polymerisable LC medium and polymer film with flat optical dispersion MERCK PATENT GMBH (DE) 2022-02-15 — — US disclosed
EP-3548586-B1 POLYMERISABLE LC MEDIUM AND POLYMER FILM WITH FLAT OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2020-09-23 — — EP disclosed
US-10435628-B2 Polymerisable LC medium and polymer film with negative optical dispersion MERCK PATENT GMBH (DE) 2019-10-08 — — US disclosed
US-10023743-B2 Dichroic pigment compounds and compositions containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-07-17 — — US disclosed
US-10005960-B2 Composition and polarizing film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-06-26 — — US disclosed
US-20180037739-A1 COMPOUND AND COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-08 — — US disclosed
US-20180030354-A1 COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 — — US disclosed
CN-104803846-A Method for the preparation of bis[4-(6-acryloyloxy-hexyl)-phenyl]cyclohexane-1,4-dicarboxylate MERCK PATENT GMBH 2015-07-29 — — CN disclosed
EP-2494004-B1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2013-09-25 — — EP disclosed
US-8470198-B2 Mesogenic compounds comprising discotic and calamitic groups MERCK PATENT GMBH (DE) 2013-06-25 — — US disclosed
US-8470198-B2 Mesogenic compounds comprising discotic and calamitic groups MERCK PATENT GMBH (DE) 2013-06-25 — — US disclosed
US-20120224245-A1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION Merck Patent Gesellschaft mit bescrankter Haftung (DE) 2012-09-06 — — US disclosed
US-20120224245-A1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION Merck Patent Gesellschaft mit bescrankter Haftung (DE) 2012-09-06 — — US disclosed
US-20110147659-A1 MESOGENIC COMPOUNDS COMPRISING DISCOTIC AND CALAMITIC GROUPS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-06-23 — — US disclosed
US-20110147659-A1 MESOGENIC COMPOUNDS COMPRISING DISCOTIC AND CALAMITIC GROUPS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2011-06-23 — — US disclosed
WO-2011050896-A1 POLYMERISABLE LC MATERIAL AND POLYMER FILM WITH NEGATIVE OPTICAL DISPERSION MERCK PATENT GMBH (DE) 2011-05-05 — — WO disclosed
WO-2010020312-A1 MESOGENIC COMPOUNDS COMPRISING DISCOTIC AND CALAMITIC GROUPS MERCK PATENT GMBH (DE) 2010-02-25 — — WO 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 (1 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-20110147659-A1 MESOGENIC COMPOUNDS COMPRISING DISCOTIC AND CALAMITIC GROUPS CALD1, DIAPH1, CALR THRB 4767/4885TSHR 4625/4885ALDH1A1 4297/4885

“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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