SCHEMBL13164751

SCHEMBL13164751

C=CC(=O)OCCCCCOc1ccc(C(=O)Oc2ccc(/C=C/C(=O)OC)cc2OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA4 P22748 2/20 0.56
CA9 Q16790 2/20 0.56
FDPS P14324 2/20 0.54
KDM4E B2RXH2 5/20 0.48
MAPT P10636 4/20 0.48
LMNA P02545 1/20 0.48
ACHE P22303 3/20 0.46
BCHE P06276 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
JAK2 O60674 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
ALOX5 P09917 2/20 0.46

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
SCHEMBL13164750 1.00 CA12 (0.56) CA12CA1CA2CA4CA9
SCHEMBL13164753 0.94 FDPS (0.59) CA12CA1CA2CA4CA9
SCHEMBL18993901 0.94 CA12 (0.57) CA12CA1CA2CA4CA9
SCHEMBL15693396 0.93 CA12 (0.56) CA12CA1CA2CA4CA9
SCHEMBL18993902 0.93 CA12 (0.53) CA12CA1CA2CA4CA9
SCHEMBL14232135 0.92 CA12 (0.57) CA12CA1CA2CA4CA9
SCHEMBL13091335 0.91 CA12 (0.48) CA12CA1CA2CA4CA9
SCHEMBL18993904 0.90 CA12 (0.54) CA12CA1CA2CA4CA9
SCHEMBL23938694 0.90 FDPS (0.55) CA12CA1CA2CA4CA9
SCHEMBL21989443 0.90 CA12 (0.53) CA12CA1CA2CA4CA9

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-7794802-B2 Polymerizable liquid crystal compound, composition and polymer CHISSO CORPORATION (JP) 2010-09-14 US disclosed
US-20100076171-A1 Polymerizable liquid crystal compound, composition and polymer CHISSO CORPORATION 2010-03-25 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-20100076171-A1 Polymerizable liquid crystal compound, composition and polymer LSS, SFXN1, FRG1 CA12 2797/4885CA1 1290/4885CA2 3412/4885

“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.