SCHEMBL19624673

SCHEMBL19624673

C=C(C)C(=O)OCCc1cc(-c2ccc(-c3ccc4cc(CCCCC)ccc4c3)cc2)ccc1OCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.41
MAPT P10636 3/20 0.41
MAPK1 P28482 3/20 0.41
THRB P10828 3/20 0.41
APAF1 O14727 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RAD52 P43351 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PTPN11 Q06124 2/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL19797143 0.99 HTT (0.41) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19624536 0.97 MAPK1 (0.39) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19624679 0.94 HTT (0.38) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19796621 0.93 HTT (0.42) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19796256 0.92 THRB (0.44) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19624601 0.92 ESR1 (0.35) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19624585 0.90 RARB (0.42) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19796631 0.90 HTT (0.42) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19624533 0.89 THRB (0.42) HTTMAPTMAPK1THRBAPAF1
SCHEMBL19624416 0.89 PDE4A (0.36) HTTPOLBTDP1ESR1RARB

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
EP-3246305-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-11-22 EP 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 HTT 4544/4885MAPT 2308/4885MAPK1 687/4885

“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.