SCHEMBL19804444

SCHEMBL19804444

C=CC(=O)OCCOc1cc(-c2ccc(C3CCCCC3)cc2)ccc1CO

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.39
FFAR4 Q5NUL3 2/20 0.38
HPGD P15428 1/20 0.37
SLC6A9 P48067 3/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
PTGDR Q13258 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 1/20 0.35
DHODH Q02127 1/20 0.34
APP P05067 1/20 0.33
MCHR1 Q99705 2/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 1/20 0.33
HSP90AA1 P07900 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL19804488 0.93 THRB (0.38) THRBFFAR4HPGDSLC6A9PTGDR2
SCHEMBL19804724 0.91 CYP3A4 (0.46) THRBFFAR4HPGDSLC6A9PTGDR2
SCHEMBL19804499 0.91 FFAR4 (0.39) THRBFFAR4HPGDSLC6A9PTGDR2
SCHEMBL19624415 0.90 THRB (0.40) THRBFFAR4HPGD
SCHEMBL19804437 0.87 FFAR4 (0.38) THRBFFAR4HPGDPTGDR2PTGDR
SCHEMBL19804235 0.85 FFAR4 (0.37) FFAR4HPGDSLC6A9PTGDR2PTGDR
SCHEMBL19804752 0.85 CYP3A4 (0.44) THRBFFAR4SLC6A9PTGDR2PTGDR
SCHEMBL19804428 0.85 FFAR4 (0.40) THRBFFAR4SLC6A9CYP3A4CYP2C9
SCHEMBL19804504 0.84 SLC6A9 (0.39) THRBFFAR4SLC6A9PTGDR2PTGDR
SCHEMBL19007875 0.84 CNR2 (0.35) THRBFFAR4HPGDCYP2C9MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, C1S, AP3D1 THRB 4323/4885FFAR4 1715/4885HPGD 4741/4885

“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.