SCHEMBL19804680

SCHEMBL19804680

C=CC(=O)OCCOc1cc(-c2ccc(-c3ccc(C4CCCCC4)cc3)c(CC)c2)ccc1OCCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.39
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 1/20 0.38
APP P05067 1/20 0.36
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
RARG P13631 1/20 0.35
MCHR1 Q99705 3/20 0.35
PPARG P37231 2/20 0.35
PPARA Q07869 1/20 0.35
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 2/20 0.35
SLC6A9 P48067 2/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 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
SCHEMBL19804428 0.92 FFAR4 (0.40) FFAR4CYP3A4CYP2C9APPRARA
SCHEMBL19804726 0.90 FFAR4 (0.41) FFAR4CYP3A4CYP2C9APPRARA
SCHEMBL19804682 0.89 RARA (0.38) FFAR4CYP3A4CYP2C9APPRARA
SCHEMBL19797046 0.87 FFAR4 (0.33) FFAR4CYP2C9RARARARBRARG
SCHEMBL19804656 0.86 RARA (0.37) FFAR4CYP3A4CYP2C9APPRARA
SCHEMBL19804692 0.86 CYP3A4 (0.46) FFAR4CYP3A4CYP2C9APPRARA
SCHEMBL19804504 0.84 SLC6A9 (0.39) FFAR4CYP3A4CYP2C9MCHR1PPARG
SCHEMBL19804489 0.84 THRB (0.45) RARARARBRARGKDM4EKMT2A
SCHEMBL19804541 0.83 FFAR4 (0.37) FFAR4CYP3A4CYP2C9APPMCHR1
SCHEMBL19804466 0.83 SLC6A9 (0.38) FFAR4CYP3A4MCHR1PPARGPPARA

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 FFAR4 1715/4885CYP3A4 2192/4885CYP2C9 4202/4885

“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.