SCHEMBL4241337

SCHEMBL4241337

CCN(CC)CCNC(=O)c1cc(C=C2C(=O)Nc3cc(-c4ccc(OC)cc4OC)ccc32)[se]c1C

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 18/20 0.80
KDR P35968 1/20 0.52
FLT3 P36888 1/20 0.48
AURKB Q96GD4 1/20 0.48

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
SCHEMBL4241334 1.00 CHEK1 (0.80) CHEK1KDRFLT3AURKB
SCHEMBL4021457 0.93 CHEK1 (0.82) CHEK1
SCHEMBL4021467 0.93 CHEK1 (0.82) CHEK1
SCHEMBL4016657 0.92 CHEK1 (0.84) CHEK1
SCHEMBL4016660 0.92 CHEK1 (0.84) CHEK1
SCHEMBL4015290 0.89 CHEK1 (1.00) CHEK1
SCHEMBL4015294 0.89 CHEK1 (1.00) CHEK1
SCHEMBL4016918 0.85 CHEK1 (1.00) CHEK1
SCHEMBL4016913 0.85 CHEK1 (1.00) CHEK1
SCHEMBL4013881 0.83 CHEK1 (0.75) CHEK1

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-20090163494-A1 PROTEIN KINASE INHIBITORS DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2009-06-25 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-20090163494-A1 PROTEIN KINASE INHIBITORS BRAF, MAP3K20, SELENOI CHEK1 120/4885KDR 2756/4885FLT3 641/4885

“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.