SCHEMBL17370463

SCHEMBL17370463

C=CC(=O)Oc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccc(OC(=O)C=C)cc4)c(OC(=O)C=C)c3OC(=O)C=C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.44
ACACB O00763 7/20 0.37
FFAR1 O14842 3/20 0.36
PDE6D O43924 1/20 0.34
APP P05067 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
HAO1 Q9UJM8 1/20 0.30

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
SCHEMBL17370250 1.00 THRB (0.44) THRBACACBFFAR1PDE6DAPP
SCHEMBL17370252 0.90 THRB (0.38) THRBACACBFFAR1PDE6DPTGDR2
SCHEMBL17370468 0.90 THRB (0.42) THRBACACBFFAR1PDE6DAPP
SCHEMBL17370465 0.90 THRB (0.39) THRBACACBFFAR1PDE6DHAO1
SCHEMBL17370462 0.89 ELANE (0.42) THRBACACBFFAR1NFKB1NFKB2
SCHEMBL17370460 0.89 THRB (0.41) THRBACACBFFAR1
SCHEMBL17370432 0.88 THRB (0.45) THRBACACBFFAR1PDE6D
SCHEMBL12348184 0.88 THRB (0.53) THRBACACBFFAR1PDE6DAPP
SCHEMBL16182694 0.88 THRB (0.53) THRBACACBFFAR1PDE6DAPP
SCHEMBL16182731 0.86 THRB (0.43) THRBACACBFFAR1PDE6DAPP

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-9708534-B2 Polymerizable compound having triple bond, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-07-18 US disclosed
US-9708534-B2 Polymerizable compound having triple bond, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-07-18 US disclosed
US-20150376505-A1 POLYMERIZABLE COMPOUND HAVING TRIPLE BOND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-31 US disclosed
US-20150376505-A1 POLYMERIZABLE COMPOUND HAVING TRIPLE BOND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-31 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 (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-20150376505-A1 POLYMERIZABLE COMPOUND HAVING TRIPLE BOND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CCNT1, CCNA1, CCND1 THRB 4828/4885ACACB 2790/4885FFAR1 1862/4885

“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.