SCHEMBL19804124

SCHEMBL19804124

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 8/20 0.43
FFAR1 O14842 7/20 0.43
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38
PTGER2 P43116 1/20 0.38
MAOB P27338 2/20 0.38
ALDH2 P05091 1/20 0.37
MAOA P21397 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
DHODH Q02127 1/20 0.36
SRD5A2 P31213 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL19804173 0.93 TDP1 (0.43) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804213 0.88 PRKAB2 (0.38) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804153 0.86 FFAR1 (0.40) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19796348 0.86 ALDH1A1 (0.42) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804624 0.86 FFAR4 (0.42) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19624632 0.85 POLB (0.37) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804711 0.84 PTGER1 (0.44) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804563 0.84 PPARG (0.40) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804604 0.84 POLB (0.44) FFAR4FFAR1POLBAPEX1HTT
SCHEMBL19804681 0.84 POLB (0.44) FFAR4FFAR1POLBAPEX1HTT

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 1715/4885FFAR1 1057/4885POLB 3105/4885

“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.