SCHEMBL19797141

SCHEMBL19797141

C=C(C)C(=O)OCCc1cc(-c2ccc3cc(C4CCC(CCCCC)CC4)ccc3c2)ccc1OCCO

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.34
PPARD Q03181 10/20 0.34
PPARG P37231 6/20 0.33
DGAT1 O75907 1/20 0.33
SOAT1 P35610 1/20 0.33
TSHR P16473 2/20 0.32
FPR2 P25090 1/20 0.32

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
SCHEMBL19007877 0.93 TSHR (0.34) PPARAPPARDPPARGDGAT1SOAT1
SCHEMBL17070423 0.90 PPARD (0.33) PPARAPPARDPPARGDGAT1SOAT1
SCHEMBL20171737 0.90 TSHR (0.34) PPARAPPARDPPARGTSHR
SCHEMBL19796633 0.90 TSHR (0.34) PPARAPPARDPPARGTSHR
SCHEMBL19796632 0.90 PPARG (0.33) PPARAPPARDPPARGTSHR
SCHEMBL17070431 0.90 PPARD (0.33) PPARAPPARDPPARGDGAT1SOAT1
SCHEMBL19796638 0.89 TSHR (0.36) PPARAPPARDPPARGDGAT1SOAT1
SCHEMBL19007866 0.89 PPARD (0.37) PPARAPPARDPPARGDGAT1SOAT1
SCHEMBL19796630 0.89 PPARD (0.38) PPARAPPARDPPARGDGAT1SOAT1
SCHEMBL20171741 0.88 PPARG (0.32) PPARAPPARDPPARGTSHR

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 PPARA 3672/4885PPARD 3071/4885PPARG 3314/4885

“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.