SCHEMBL3120551

SCHEMBL3120551

C=C(C)Oc1ccc(C(=O)c2ccccc2)c(OC(=C)C)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.76
MAPK1 P28482 3/20 0.76
ELANE P08246 6/20 0.64
KDM4E B2RXH2 4/20 0.53
POLB P06746 2/20 0.49
LMNA P02545 4/20 0.49
HPGD P15428 2/20 0.49
HTT P42858 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
ALDH1A1 P00352 1/20 0.49
PGR P06401 1/20 0.49
CYP2D6 P10635 1/20 0.49
SLC6A2 P23975 1/20 0.49
PDE4A P27815 1/20 0.49
HRH1 P35367 1/20 0.49
SLC6A3 Q01959 1/20 0.49
PDE4D Q08499 1/20 0.49
NPC1 O15118 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL3122010 0.85 MAPT (0.58) MAPTMAPK1ELANEKDM4ELMNA
SCHEMBL3113752 0.85 HPGD (0.68) MAPTMAPK1ELANEKDM4ELMNA
SCHEMBL4622496 0.82 MAPT (0.66) MAPTMAPK1ELANEKDM4EPOLB
SCHEMBL11316893 0.79 MAPK1 (0.67) MAPTMAPK1ELANEKDM4EPOLB
SCHEMBL13133207 0.79 MAPT (0.79) MAPTMAPK1ELANEKDM4EPOLB
SCHEMBL29050458 0.79 MAPK1 (0.61) MAPTMAPK1ELANEKDM4EPOLB
SCHEMBL10483738 0.78 ELANE (1.00) MAPTMAPK1ELANE
SCHEMBL9211658 0.78 MAPT (0.68) MAPTMAPK1ELANEKDM4EPOLB
SCHEMBL6534743 0.77 MAPK1 (0.59) MAPTMAPK1ELANEKDM4EPOLB
SCHEMBL28810896 0.77 MAPT (0.59) MAPTMAPK1ELANEKDM4EPOLB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732645-B2 Aromatic vinyl ether compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-06-08 US disclosed
EP-2161248-A1 Aromatic vinyl ether compounds Daicel Chemical Industries, Ltd. (JP) 2010-03-10 EP disclosed
US-7518021-B2 Aromatic vinyl ether compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-04-14 US disclosed
US-20090088592-A1 AROMATIC VINYL ETHER COMPOUNDS IWAHAMA TAKAHIRO 2009-04-02 US disclosed
US-20040181098-A1 Aromatic vinyl ether compounds EMORY UNIVERSITY 2004-09-16 US disclosed
EP-1413568-A2 Aromatic vinyl ether compounds Daicel Chemical Industries, Ltd. (JP) 2004-04-28 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 (2 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-20040181098-A1 Aromatic vinyl ether compounds SUV39H2, SUV39H1, RAVER1 MAPT 2131/4885MAPK1 2088/4885ELANE 2856/4885
US-20090088592-A1 AROMATIC VINYL ETHER COMPOUNDS SUV39H2, SUV39H1, RAVER1 MAPT 2199/4885MAPK1 3015/4885ELANE 2854/4885

“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.