SCHEMBL816423

SCHEMBL816423

C=CC(=O)OC1CCC(C2CCC(CCCCC)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.41
HPGD P15428 2/20 0.39
TSHR P16473 2/20 0.39
PKM P14618 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 2/20 0.35
THRB P10828 3/20 0.35
THRA P10827 2/20 0.35
POLB P06746 1/20 0.33
CCR2 P41597 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 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
SCHEMBL74578 0.99 NAAA (0.41) NAAAHPGDTSHRPKMMEN1
SCHEMBL74620 0.96 NAAA (0.45) NAAAHPGDTSHRPKMMEN1
SCHEMBL13552025 0.92 NAAA (0.36) NAAAHPGDTSHRPKMMEN1
SCHEMBL6521225 0.91 NAAA (0.48) NAAAHPGDTSHRPKMMEN1
SCHEMBL74873 0.90 TLR4 (0.37) NAAAHPGDTSHRKMT2ACYP2C9
SCHEMBL14075604 0.88 NAAA (0.43) NAAAHPGDPKMMEN1KMT2A
SCHEMBL14075598 0.88 NAAA (0.43) NAAAHPGDPKMMEN1KMT2A
SCHEMBL9176940 0.83 NAAA (0.42) NAAAHPGDTSHRPKMMEN1
SCHEMBL9176952 0.83 NAAA (0.42) NAAAHPGDTSHRPKMMEN1
SCHEMBL9176928 0.83 NAAA (0.42) NAAAHPGDTSHRPKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 US disclosed
US-10982146-B2 Liquid crystal composition, liquid crystal element, and use of liquid crystal composition in liquid crystal element JNC CORPORATION (JP) 2021-04-20 US disclosed
US-10865344-B2 Low molecular weight polar compound for homogeneously aligning liquid crystal medium, and liquid crystal medium containing same JNC CORPORATION (JP) 2020-12-15 US disclosed
EP-3392324-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2020-12-09 EP disclosed
US-10787608-B2 Liquid crystal display device including liquid crystal medium containing low molecular weight polar compound for homogeneously aligning liquid crystal medium JNC CORPORATION (JP) 2020-09-29 US disclosed
US-20200264461-A1 LIGHT CONVERSION FILM AND IMAGE DISPLAY DEVICE DIC CORPORATION (JP) 2020-08-20 US disclosed
US-20200199452-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, OPTICAL FILM INCLUDING THE SAME, AND METHOD FOR PRODUCING OPTICAL FILM DIC CORPORATION (JP) 2020-06-25 US disclosed
US-10442992-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-10-15 US disclosed
US-10428275-B2 Method for manufacturing liquid crystal display device and liquid crystal display device JNC CORPORATION (JP) 2019-10-01 US disclosed
US-20190292455-A1 LOW MOLECULAR WEIGHT POLAR COMPOUND FOR HOMOGENEOUSLY ALIGNING LIQUID CRYSTAL MEDIUM, AND LIQUID CRYSTAL MEDIUM CONTAINING SAME JNC CORPORATION (JP) 2019-09-26 US disclosed
US-20110037025-A1 TRIFUNCTIONAL (METH)ACRYLATE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING SAME ADEKA CORPORATION (JP) 2011-02-17 US disclosed
US-20110037025-A1 TRIFUNCTIONAL (METH)ACRYLATE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING SAME ADEKA CORPORATION (JP) 2011-02-17 US disclosed
EP-2261201-A1 TRIFUNCTIONAL (METH)ACRYLATE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE COMPOUND Adeka Corporation (JP) 2010-12-15 EP disclosed
US-7820250-B2 Liquid crystal optical modulation element and optical head device ASAHI GLASS COMPANY, LIMITED (JP) 2010-10-26 US disclosed
US-20100032621-A1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS ADEKA CORPORATION (JP) 2010-02-11 US disclosed
US-20100032620-A1 POLYMERIZABLE OPTICAL ACTIVE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE SAME ADEKA CORPORATION (JP) 2010-02-11 US disclosed
US-7442418-B2 Polymerizable liquid crystal compound, liquid crystal composition, optical anisotropic material and optical element ASAHI GLASS COMPANY, LIMITED (JP) 2008-10-28 US disclosed
US-7371438-B2 Polymerizable liquid crystal compound, liquid crystal composition and optical anisotropic material ASAHI GLASS COMPANY, LIMITED (JP) 2008-05-13 US disclosed
US-20070102669-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND OPTICAL ANISOTROPIC MATERIAL ASAHI GLASS COMPANY, LIMITED (JP) 2007-05-10 US disclosed
US-20070104894-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIC MATERIAL AND OPTICAL ELEMENT ASAHI GLASS CO., LTD. (JP) 2007-05-10 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 (5 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-20100032620-A1 POLYMERIZABLE OPTICAL ACTIVE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE SAME C1S, PYM1, MCCC2 NAAA 4313/4885HPGD 4696/4885TSHR 4219/4885
US-10787608-B2 Liquid crystal display device including liquid crystal medium containing low molecular weight polar compound for homogeneously aligning liquid crystal medium ACP1, MAPK1, PLD1 NAAA 4096/4885HPGD 4460/4885TSHR 4292/4885
US-20100032621-A1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS CHRM1, CHRM2, CCNE1 NAAA 2824/4885HPGD 2367/4885TSHR 4784/4885
US-20110037025-A1 TRIFUNCTIONAL (METH)ACRYLATE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING SAME PYM1, MT-CO1, MAT1A NAAA 3943/4885HPGD 3793/4885TSHR 1707/4885
US-10865344-B2 Low molecular weight polar compound for homogeneously aligning liquid crystal medium, and liquid crystal medium containing same ACP1, MFAP1, PHOSPHO1 NAAA 3599/4885HPGD 4734/4885TSHR 4736/4885

“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.