SCHEMBL1643407

SCHEMBL1643407

COc1ccccc1N=Cc1cccc(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
BCHE P06276 8/20 0.50
MAOB P27338 1/20 0.50
ERN1 O75460 1/20 0.42
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
PTGER4 P35408 2/20 0.41
PTGER3 P43115 2/20 0.41
PTGER2 P43116 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
PTGER1 P34995 1/20 0.40
ALOX12 P18054 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTR1A P08908 1/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39

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
SCHEMBL12727678 1.00 KDM4E (0.52) KDM4EBCHEMAOBERN1MGAM
SCHEMBL1643406 1.00 KDM4E (0.52) KDM4EBCHEMAOBERN1MGAM
SCHEMBL12727688 0.92 MAOB (0.51) KDM4EBCHEMAOBERN1MGAM
SCHEMBL12675703 0.85 SMN1; SMN2 (0.40) KDM4EMAOBGAASMN1; SMN2NPSR1
SCHEMBL12727683 0.83 KDM4E (0.51) KDM4EBCHEMAOBPTGER4PTGER3
SCHEMBL1759270 0.82 KDM4E (0.48) KDM4EBCHEMAOBERN1MGAM
SCHEMBL12725985 0.79 BCHE (0.57) KDM4EBCHEMGAMGAASI
SCHEMBL1897191 0.77 MGAM (0.45) KDM4EBCHEMAOBERN1MGAM
SCHEMBL12675961 0.77 ALDH1A1 (0.41) KDM4EMAOBGAASMN1; SMN2NPSR1
SCHEMBL12727681 0.76 MAOB (0.47) KDM4EBCHEMAOBSMN1; SMN2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530593-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-10 US disclosed
WO-2011056432-A2 CATALYST COMPOUNDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-05-12 WO disclosed
US-20110098431-A1 Catalyst Compounds and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 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-20110098431-A1 Catalyst Compounds and Use Thereof PAM, AAAS, PAOX KDM4E 3249/4885BCHE 4506/4885MAOB 631/4885

“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.