SCHEMBL4013829

SCHEMBL4013829

Cc1ccc(/C=C2\C(=O)Nc3ccc(F)cc32)[se]1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
CHEK1 O14757 2/20 0.57
FLT3 P36888 3/20 0.56
CDK2 P24941 4/20 0.52
CCNE1 P24864 2/20 0.52
CCNE2 O96020 1/20 0.52
ALK Q9UM73 1/20 0.52
RPS6KA3 P51812 1/20 0.48
KDR P35968 3/20 0.47
PDGFRB P09619 1/20 0.46
MDM2 Q00987 1/20 0.46
FLT1 P17948 1/20 0.45
SRC P12931 1/20 0.45

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
SCHEMBL4013834 1.00 MEN1 (0.60) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL4014512 0.84 ALK (0.57) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL4014510 0.84 ALK (0.57) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL4015690 0.81 FLT3 (0.50) MEN1KMT2AFLT3CDK2CCNE1
SCHEMBL4015685 0.81 FLT3 (0.50) MEN1KMT2AFLT3CDK2CCNE1
SCHEMBL4021592 0.78 CHEK1 (0.62) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL4021596 0.78 CHEK1 (0.62) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL4014882 0.77 FLT3 (0.57) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL4014887 0.77 FLT3 (0.57) MEN1KMT2ACHEK1FLT3CDK2
SCHEMBL14674721 0.77 KDR (0.66) MEN1KMT2AFLT3CDK2CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009085040-A1 PROTEIN KINASE INHIBITORS DCB-USA LLC (US) 2009-07-09 WO disclosed
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 MEN1 893/4885KMT2A 1340/4885CHEK1 120/4885

“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.