SCHEMBL4178094

SCHEMBL4178094

O=c1c(-c2ccccc2)coc2c(Cl)c(O)ccc12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.74
ALOX12 P18054 6/20 0.74
PIK3CA P42336 5/20 0.62
KDM4E B2RXH2 5/20 0.60
ALDH1A1 P00352 4/20 0.60
HPGD P15428 3/20 0.60
HSD17B10 Q99714 3/20 0.60
RCE1 Q9Y256 1/20 0.60
KLK7 P49862 1/20 0.58
XDH P47989 1/20 0.57
PFKFB3 Q16875 1/20 0.57
NPC1 O15118 1/20 0.54
POLB P06746 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.50
GAA P10253 1/20 0.50
RECQL P46063 1/20 0.50

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
SCHEMBL10562974 0.85 ALOX15 (1.00) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL4194426 0.82 ALOX15 (0.74) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL4300469 0.82 ALOX15 (0.74) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL10486563 0.80 ALOX15 (0.70) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL16227303 0.80 ALOX15 (0.70) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL8983948 0.79 ALDH1A1 (0.56) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL8983892 0.76 ALDH1A1 (0.56) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL12325677 0.76 ALOX15 (0.64) ALOX15ALOX12KDM4EALDH1A1HPGD
SCHEMBL10560725 0.75 ALOX15 (1.00) ALOX15ALOX12PIK3CAKDM4EALDH1A1
SCHEMBL14157759 0.75 ALOX15 (0.58) ALOX15ALOX12PIK3CAKDM4EALDH1A1

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-20090192152-A1 Novel Antigiardial Agents and Methods of Use Thereof UNIVERSITY OF MISSISSIPPI 2009-07-30 US disclosed
US-7468445-B2 Antigiardial agents and use thereof UNIVERSITY OF MISSISSIPPI (US) 2008-12-23 US disclosed
US-20060106091-A1 Antigiardial agents and use thereof THE UNIVERSITY OF MISSISSIPPI 2006-05-18 US disclosed
WO-2004014886-A1 ANTIGIARDIAL AGENTS AND USE THEREOF UNIVERSITY OF MISSISSIPPI (US) 2004-02-19 WO 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-20060106091-A1 Antigiardial agents and use thereof GPER1, ENPP2, ALPI ALOX15 336/4885ALOX12 385/4885PIK3CA 1459/4885
US-20090192152-A1 Novel Antigiardial Agents and Methods of Use Thereof ENPP2, GPER1, ALPI ALOX15 328/4885ALOX12 393/4885PIK3CA 1588/4885

“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.