SCHEMBL6509372

SCHEMBL6509372

N#Cc1ccc(-c2ccc(-c3nc4cc(C#N)ccc4[nH]3)cc2)c(OCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.50
CYP19A1 P11511 2/20 0.49
CYP11B1 P15538 2/20 0.49
CYP11B2 P19099 2/20 0.49
DHODH Q02127 1/20 0.46
RHEB Q15382 1/20 0.45
PRMT5 O14744 9/20 0.44
PKN1 Q16512 1/20 0.42
PKN2 Q16513 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL2570360 0.80 CYP19A1 (0.62) CYP19A1CYP11B1CYP11B2
SCHEMBL28267390 0.79 CHEK2 (0.61) CHEK2CYP19A1RHEBPKN1PKN2
SCHEMBL8410194 0.76 CHEK2 (0.81) CHEK2RHEBPKN1PKN2
SCHEMBL6511501 0.76 DHODH (0.47) CHEK2DHODHPRMT5PDE4APDE4B
SCHEMBL6062255 0.75 RHEB (0.54) CHEK2RHEBPKN1PKN2
SCHEMBL6061899 0.74 CYP19A1 (0.53) CYP19A1CYP11B1CYP11B2
SCHEMBL8412123 0.74 RHEB (0.59) CHEK2RHEBPKN1PKN2
SCHEMBL8409891 0.72 CHEK2 (0.70) CHEK2RHEBPKN1PKN2
SCHEMBL31289493 0.72 CHEK2 (0.61) CHEK2DHODHPRMT5
SCHEMBL3333407 0.72 RHEB (0.68) CHEK2RHEBPKN1PKN2

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 CHEK2 2931/4885CYP19A1 3935/4885CYP11B1 845/4885

“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.