SCHEMBL3437314

SCHEMBL3437314

C=CC(=O)OCCCCCCOc1ccc(-c2ccc(/C=C/C(=O)Oc3ccc(-c4ccc(C(=O)OCCOC(=O)C=C)cc4)cc3)cc2F)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 0.39
THRB P10828 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
HTT P42858 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALOX5 P09917 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
CYSLTR1 Q9Y271 1/20 0.34
RARB P10826 1/20 0.34

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
SCHEMBL3437310 0.92 CA12 (0.44) APPTHRBCA12CA1CA4
SCHEMBL20929817 0.90 KMT2A (0.41) APPTHRBCA12CA1CA4
SCHEMBL3437308 0.88 CA12 (0.49) APPTHRBCA12CA1CA4
SCHEMBL13904899 0.88 HTT (0.43) APPTHRBHTTKMT2ARARB
SCHEMBL17340243 0.87 APP (0.40) APPTHRBCA12CA1CA4
SCHEMBL13904892 0.87 THRB (0.43) THRBHTTKMT2AKDM4E
SCHEMBL21082803 0.86 THRB (0.35) APPTHRBCA12CA1CA4
SCHEMBL18324435 0.86 POLB (0.41) APPCA12CA1CA4CA6
SCHEMBL18541170 0.85 ALOX5 (0.36) APPTHRBCA12CA1CA4
SCHEMBL20414537 0.84 APP (0.41) APPTHRBCA12CA1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11312906-B2 Polymerizable monomer, liquid crystal composition using polymerizable monomer, and liquid crystal display device DIC CORPORATION (JP) 2022-04-26 US disclosed
EP-3450523-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DAINIPPON INK & CHEMICALS (JP) 2021-01-06 EP disclosed
US-20200224098-A1 POLYMERIZABLE MONOMER, LIQUID CRYSTAL COMPOSITION USING POLYMERIZABLE MONOMER, AND LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2020-07-16 US disclosed
US-20200208054-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT DIC Corporation (Tokyo) (JP) 2020-07-02 US disclosed
US-10690952-B2 Liquid crystal display element DIC CORPORATION (JP) 2020-06-23 US disclosed
US-10633590-B2 Liquid crystal composition and liquid crystal display device including the same DIC CORPORATION (JP) 2020-04-28 US disclosed
US-10465113-B2 Nematic liquid crystal composition, and liquid crystal display element manufactured using same DIC CORPORATION (JP) 2019-11-05 US disclosed
US-10351772-B2 Nematic liquid crystal composition and liquid crystal display element using same DIC CORPORATION (JP) 2019-07-16 US disclosed
WO-2019078016-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC株式会社 2019-04-25 WO disclosed
US-20190119575-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2019-04-25 US disclosed
US-20160319192-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT INCLUDING THE SAME DIC CORPORATION (JP) 2016-11-03 US disclosed
US-20160075947-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2016-03-17 US disclosed
US-9260661-B2 Nematic liquid crystal composition and liquid crystal display element including the same DIC CORPORATION (JP) 2016-02-16 US disclosed
US-9260661-B2 Nematic liquid crystal composition and liquid crystal display element including the same DIC CORPORATION (JP) 2016-02-16 US disclosed
US-20150315469-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC Corporation (Tokyo) (JP) 2015-11-05 US disclosed
US-20150315469-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC Corporation (Tokyo) (JP) 2015-11-05 US disclosed
US-20150218450-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT INCLUDING THE SAME DIC CORPORATION (JP) 2015-08-06 US disclosed
US-20150218450-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT INCLUDING THE SAME DIC CORPORATION (JP) 2015-08-06 US disclosed
US-20120097895-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2012-04-26 US disclosed
US-20120097895-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2012-04-26 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-10465113-B2 Nematic liquid crystal composition, and liquid crystal display element manufactured using same LBR, VSIR, KIF23 APP 2357/4885THRB 4324/4885CA12 2052/4885
US-10633590-B2 Liquid crystal composition and liquid crystal display device including the same LASP1, UACA, CCDC22 APP 1323/4885THRB 4521/4885CA12 1981/4885

“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.