SCHEMBL1637643

SCHEMBL1637643

COc1ccccc1-c1cccc(C(C)(O)c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCHE P06276 11/20 0.43
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 2/20 0.41
HTR1A P08908 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
PTGER1 P34995 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL12726007 0.89 BCHE (0.44) BCHEKDM4EL3MBTL1MAPTHTR1A
SCHEMBL1637529 0.87 PTPN5 (0.48) BCHEKDM4EL3MBTL1MGAMGAA
SCHEMBL12646929 0.84 CNR1 (0.44) KDM4EL3MBTL1MAPTGAAMEN1
SCHEMBL1638726 0.83 PTPN5 (0.47) BCHEMGAMGAASIMGAM2
SCHEMBL1638857 0.83 MGAM (0.46) BCHEKDM4EL3MBTL1HTR1AADRA1D
SCHEMBL1637791 0.81 PTPN5 (0.42) BCHEKDM4EL3MBTL1MGAMGAA
SCHEMBL1639404 0.81 MGAM (0.44) BCHEKDM4EL3MBTL1MGAMGAA
SCHEMBL27864181 0.79 MAOB (0.48) BCHEKDM4EL3MBTL1HTR1AMGAM
SCHEMBL1638077 0.79 MGAM (0.44) BCHEKDM4EL3MBTL1HTR1AADRA1D
SCHEMBL27894243 0.79 MGAM (0.45) BCHEKDM4EL3MBTL1MGAMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541521-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
US-8541521-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
US-20110098427-A1 Catalyst Compounds And Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 US disclosed
US-20110098427-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-20110098427-A1 Catalyst Compounds And Use Thereof THEM6, OPRM1, NOTUM BCHE 3273/4885KDM4E 4604/4885L3MBTL1 2086/4885

“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.