SCHEMBL19804141

SCHEMBL19804141

C=C(C)C(=O)OCCc1cc(-c2ccc(C)cc2)ccc1OCCO

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
RARB P10826 3/20 0.38
RARG P13631 3/20 0.38
RARA P10276 2/20 0.38
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
MAPK1 P28482 1/20 0.35
THRB P10828 1/20 0.35
SLC6A9 P48067 3/20 0.35
SYK P43405 1/20 0.35
ESR1 P03372 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
ADORA3 P0DMS8 1/20 0.33

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
SCHEMBL19624678 0.96 CA1 (0.36) CA1CA2RARBRARGRARA
SCHEMBL21115767 0.93 RARA (0.38) CA1CA2RARBRARGRARA
SCHEMBL22030370 0.91 POLB (0.36) CA1CA2RARBRARGRARA
SCHEMBL19804369 0.91 SLC6A9 (0.44) RARBRARGRARAPOLBAPEX1
SCHEMBL19804140 0.91 SLC6A9 (0.44) RARBRARGRARAPOLBAPEX1
SCHEMBL19796691 0.89 ALDH1A1 (0.40) RARBRARGRARAPOLBAPEX1
SCHEMBL19804125 0.89 RARB (0.38) CA1CA2RARBRARGRARA
SCHEMBL19804137 0.88 CA1 (0.40) CA1CA2RARBRARGRARA
SCHEMBL19624496 0.88 CA1 (0.40) CA1CA2RARBRARGRARA
SCHEMBL19804164 0.88 CA1 (0.36) CA1CA2POLBAPEX1HTT

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 CA1 489/4885CA2 2120/4885RARB 3517/4885

“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.