SCHEMBL6513301

SCHEMBL6513301

COc1cc(-c2ccc(C#N)cc2)cc(-c2nc3cc(C#N)ccc3[nH]2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.44
MAPK10 P53779 1/20 0.43
AMY1A P0DUB6 4/20 0.43
F7 P08709 1/20 0.41
DGAT1 O75907 1/20 0.40
SOAT1 P35610 1/20 0.40
KCNH2 Q12809 1/20 0.40
CHEK2 O96017 2/20 0.39
CHEK1 O14757 1/20 0.39
PKN1 Q16512 1/20 0.39
PKN2 Q16513 1/20 0.39
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 1/20 0.39
PRSS1 P07477 1/20 0.39
KIT P10721 1/20 0.39
SMPD3 Q9NY59 2/20 0.38
CFB P00751 1/20 0.37

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
SCHEMBL6508250 0.86 RHEB (0.47) RHEBMAPK10AMY1AF7DGAT1
SCHEMBL6061845 0.80 RHEB (0.50) RHEBAMY1AF7DGAT1SOAT1
SCHEMBL10748660 0.80 CDK4 (0.46) RHEBMAPK10AMY1AF7CHEK1
SCHEMBL5392746 0.77 F10 (0.60) F7F2F10PLGPLAU
SCHEMBL6061276 0.77 RHEB (0.49) RHEBMAPK10AMY1AF7DGAT1
SCHEMBL6061963 0.77 KDM1A (0.42) RHEBMAPK10AMY1ADGAT1KCNH2
SCHEMBL6505174 0.76 HDAC6 (0.46) AMY1AF2F10PLGPLAU
Acetic Acid SCHEMBL6062185 0.74 F2 (0.55) F7F2F10PLGPLAU
SCHEMBL10760601 0.73 MAPK10 (0.42) RHEBMAPK10AMY1ACHEK2PKN1
SCHEMBL10765326 0.73 MAPK10 (0.42) RHEBMAPK10AMY1AF7PKN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents BOYKIN DAVID W (US) 2005-07-07 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-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents DDT, DDC, DARS1 RHEB 412/4885MAPK10 2351/4885AMY1A 4670/4885

“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.