SCHEMBL18311384

SCHEMBL18311384

CCCCOCC(=O)Oc1ccc(-c2cccc(-c3ccc(OCCCC)cc3)c2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G4B P0C869 1/20 0.45
▸ RARB P10826 5/20 0.45
▸ RARA P10276 1/20 0.45
▸ FFAR1 O14842 1/20 0.44
▸ FFAR4 Q5NUL3 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ PPARG P37231 2/20 0.43
▸ PPARA Q07869 2/20 0.43
▸ PPARD Q03181 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ERN1 O75460 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ PTGES O14684 1/20 0.41
▸ ALOX5 P09917 1/20 0.41

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
SCHEMBL17547130 0.87 RARB (0.51) PLA2G4BRARBRARAFFAR1FFAR4
SCHEMBL18411597 0.81 FFAR1 (0.50) FFAR1FFAR4PPARGPPARDERN1
SCHEMBL18311383 0.77 ERN1 (0.50) FFAR1FFAR4HDAC2ERN1ALOX5
SCHEMBL18308828 0.73 RECQL (0.44) FFAR1PPARGPPARAKMT2ASMN1; SMN2
SCHEMBL18308827 0.72 MEN1 (0.39) MEN1GAAKMT2ASMN1; SMN2MAPT
SCHEMBL27509557 0.72 PDE4A (0.50) KMT2ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL13038193 0.72 LMNA (0.59) RARBKMT2ASMN1; SMN2MAPT
SCHEMBL17547218 0.72 RARB (0.76) PLA2G4BRARBTP53
SCHEMBL18308829 0.71 ABL1 (0.49) MEN1KMT2AERN1MAPT
SCHEMBL17547129 0.71 LTA4H (0.64) RARBMEN1KMT2A

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
EP-3121247-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2017-01-25 — — EP disclosed
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-12-15 — — 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-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 PLA2G4B 3327/4885RARB 2523/4885RARA 1744/4885

“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.

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