SCHEMBL17370403

SCHEMBL17370403

C=CC(=O)OCOc1ccc(C#Cc2cc(OCOC(=O)C=C)c(C#Cc3ccc(OCOC(=O)C=C)cc3)c(OCOC(=O)C=C)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.43
FFAR1 O14842 7/20 0.39
ACACB O00763 4/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.33
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
PTPN11 Q06124 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTT P42858 1/20 0.31
APP P05067 1/20 0.31
HPGD P15428 1/20 0.30
TSHR P16473 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
SCHEMBL17370424 0.95 THRB (0.40) THRBFFAR1ACACBPTGDR2PTPN1
SCHEMBL12733803 0.87 THRB (0.50) THRBFFAR1ACACBPTPN1PTPN6
SCHEMBL19759397 0.82 THRB (0.42) THRBFFAR1ACACBPTGDR2ALDH1A1
SCHEMBL17370430 0.82 THRB (0.36) THRBFFAR1ACACB
SCHEMBL16491598 0.81 APP (0.47) THRBFFAR1ACACBAPP
SCHEMBL17370433 0.81 POLB (0.37) THRBFFAR1ACACBHTT
SCHEMBL12242566 0.80 FFAR1 (0.39) THRBFFAR1ACACBPTGDR2
SCHEMBL17370399 0.80 POLB (0.34) THRBFFAR1ACACBHTT
SCHEMBL12242522 0.80 FFAR1 (0.45) THRBFFAR1ACACBHTTHPGD
SCHEMBL12242480 0.80 FFAR1 (0.45) THRBFFAR1ACACBHTTHPGD

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 4828/4885FFAR1 1862/4885ACACB 2790/4885

“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.