SCHEMBL19803992

SCHEMBL19803992

C=C(C)C(=O)OCCOc1cc(CO)ccc1-c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.44
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
FFAR1 O14842 4/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
HTT P42858 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
THRB P10828 1/20 0.35
LMNA P02545 3/20 0.35
ALDH1A1 P00352 1/20 0.35
SYK P43405 1/20 0.35
PKM P14618 1/20 0.34
GAA P10253 1/20 0.34
CTSA P10619 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
SCHEMBL19804171 0.93 FFAR4 (0.42) FFAR4CA1CA2FFAR1CYP11B1
SCHEMBL19803987 0.92 FFAR4 (0.43) FFAR4CA1CA2CYP4F2CYP4A11
SCHEMBL19796325 0.89 CYP11B1 (0.38) FFAR4CYP4F2CYP4A11CYP11B1CYP11B2
SCHEMBL19804109 0.88 CA1 (0.35) FFAR4CA1CA2CYP4F2CYP4A11
SCHEMBL19804005 0.87 FFAR4 (0.43) FFAR4CYP4F2CYP4A11FFAR1CYP11B1
SCHEMBL19804172 0.87 FFAR4 (0.43) FFAR4CA1CA2CYP4F2CYP4A11
SCHEMBL19796420 0.87 THRB (0.38) FFAR4CYP4F2CYP4A11CYP11B1CYP11B2
SCHEMBL19804102 0.86 CYP4F2 (0.41) FFAR4CA1CA2CYP4F2CYP4A11
SCHEMBL19804273 0.85 FFAR4 (0.42) FFAR4CA1CA2CYP4F2CYP4A11
SCHEMBL19803994 0.85 CYP4F2 (0.44) FFAR4CYP4F2CYP4A11FFAR1HTT

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 1715/4885CA1 489/4885CA2 2120/4885

“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.