SCHEMBL6061276

SCHEMBL6061276

N#Cc1ccc(-c2cccc(-c3nc4cc(C#N)ccc4[nH]3)c2O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.49
F7 P08709 2/20 0.47
F2 P00734 1/20 0.46
F9 P00740 1/20 0.46
F10 P00742 1/20 0.46
PLG P00747 1/20 0.46
PLAU P00749 1/20 0.46
PLAT P00750 1/20 0.46
PRSS1 P07477 1/20 0.46
CHEK2 O96017 2/20 0.44
PKN1 Q16512 1/20 0.43
PKN2 Q16513 1/20 0.43
DGAT1 O75907 1/20 0.42
SOAT1 P35610 1/20 0.42
KCNH2 Q12809 1/20 0.42
PARP1 P09874 1/20 0.42
METAP2 P50579 1/20 0.41
METAP1 P53582 1/20 0.41
IDO1 P14902 1/20 0.41
ATR Q13535 1/20 0.41

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
SCHEMBL6061845 0.81 RHEB (0.50) RHEBF7CHEK2PKN1PKN2
SCHEMBL6505960 0.81 RHEB (0.44) RHEBF7CHEK2PKN1PKN2
SCHEMBL6061802 0.79 RHEB (0.57) RHEBCHEK2PKN1PKN2DGAT1
SCHEMBL8412123 0.79 RHEB (0.59) RHEBCHEK2PKN1PKN2DGAT1
SCHEMBL5428770 0.78 RHEB (0.52) RHEBCHEK2PKN1PKN2DGAT1
SCHEMBL22955340 0.78 MAPK10 (0.52) RHEBCHEK2PKN1PKN2METAP2
SCHEMBL6513301 0.77 RHEB (0.44) RHEBF7F2F10PLG
SCHEMBL2313456 0.77 MAPK10 (0.46) RHEBCHEK2PKN1PKN2METAP2
SCHEMBL2308879 0.76 METAP2 (0.43) RHEBF7CHEK2PKN1PKN2
SCHEMBL2308883 0.76 METAP2 (0.43) RHEBF7CHEK2PKN1PKN2

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
EP-1682518-A1 DICATIONIC TRIARYL ANALOGS AS ANTI-PROTOZOAN AGENTS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2006-07-26 EP disclosed
US-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents BOYKIN DAVID W (US) 2005-07-07 US disclosed
WO-2005040132-A1 DICATIONIC TRIARYL ANALOGS AS ANTI-PROTOZOAN AGENTS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2005-05-06 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 (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-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents DDT, DDC, DARS1 RHEB 412/4885F7 3571/4885F2 2666/4885

“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.