SCHEMBL8917358

SCHEMBL8917358

c1ccc(COc2c(Cc3ccccc3)cccc2-c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 6/20 0.45
PTGER3 P43115 6/20 0.45
PTGER1 P34995 6/20 0.45
PTGER2 P43116 5/20 0.45
GSTP1 P09211 2/20 0.41
BCHE P06276 1/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SCN8A Q9UQD0 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL12117433 0.90 ABCB1 (0.47) PTGER4PTGER3PTGER1PTGER2KDM4E
SCHEMBL8406774 0.87 PDCD1 (0.50) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL12117430 0.86 CYP11B1 (0.56) HTR1ADRD2
SCHEMBL26185970 0.85 PTGER4 (0.44) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL1758900 0.84 CYP4F2 (0.50) PTGER4PTGER3PTGER1PTGER2BCHE
SCHEMBL1758960 0.81 PTGER4 (0.44) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL12675701 0.81 SCN8A (0.48) HTR1ADRD2L3MBTL1SCN8AMAPK1
SCHEMBL12727690 0.81 HTR1A (0.49) PTGER4PTGER3PTGER1PTGER2GSTP1
SCHEMBL31613044 0.81 HTR1A (0.43) HTR1ASCN8A
SCHEMBL12843213 0.79 BCHE (0.43) PTGER4PTGER3PTGER1PTGER2BCHE

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
US-20110098431-A1 Catalyst Compounds and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 US disclosed
US-5654309-A KIDNEY, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-08-05 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 PTGER4 250/4885PTGER3 386/4885PTGER1 1043/4885

“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.