SCHEMBL19796348

SCHEMBL19796348

C=C(C)C(=O)OCc1cc(OCCO)ccc1-c1ccc(CCC)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
FFAR4 Q5NUL3 9/20 0.40
FFAR1 O14842 7/20 0.40
PTPN11 Q06124 2/20 0.40
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
THRB P10828 1/20 0.37
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL19796416 0.94 ALDH1A1 (0.42) ALDH1A1FFAR4FFAR1PTPN11SLC5A1
SCHEMBL19796353 0.89 S1PR1 (0.37) ALDH1A1FFAR4FFAR1PTPN11POLB
SCHEMBL19796368 0.88 S1PR1 (0.39) ALDH1A1FFAR4FFAR1THRB
SCHEMBL19796875 0.87 MEN1 (0.47) ALDH1A1FFAR4FFAR1PTPN11POLB
SCHEMBL19796919 0.87 MEN1 (0.47) ALDH1A1FFAR4FFAR1PTPN11POLB
SCHEMBL19804124 0.86 FFAR4 (0.43) FFAR4FFAR1PTPN11POLBAPEX1
SCHEMBL19796408 0.86 CYP4F2 (0.38) FFAR4FFAR1THRB
SCHEMBL19796331 0.86 CYP4F2 (0.38) FFAR4FFAR1THRB
SCHEMBL19796316 0.85 FFAR4 (0.36) FFAR4FFAR1THRB
SCHEMBL19796359 0.85 ALDH1A1 (0.42) ALDH1A1PTPN11POLBAPEX1HTT

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 2 patents. 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
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 ALDH1A1 2472/4885FFAR4 1715/4885FFAR1 1057/4885

“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.