SCHEMBL3585333

SCHEMBL3585333

CN1c2ccc([NH])cc2NC(=O)C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.36
PDK2 Q15119 1/20 0.33
PDK4 Q16654 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
PGR P06401 1/20 0.30

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
SCHEMBL3591081 0.87 ATAD2 (0.36) ATAD2PDK2PDK4L3MBTL1PGR
SCHEMBL3585335 0.80 NR1H2 (0.40) ATAD2PDK2PDK4L3MBTL1
SCHEMBL13382907 0.78 HTR6 (0.37) ATAD2PDK2PDK4L3MBTL1
SCHEMBL3594073 0.72 MGAT2 (0.37) PDK2PDK4PGR
SCHEMBL3596379 0.72 MGAT2 (0.37) PDK2PDK4PGR
SCHEMBL3600184 0.70 MEN1 (0.44) PGR
SCHEMBL3591085 0.70 NR1H2 (0.37) ATAD2PDK2PDK4L3MBTL1PGR
SCHEMBL3599451 0.67 PDK2 (0.44) ATAD2PDK2PDK4L3MBTL1PGR
SCHEMBL3606355 0.67 PDK2 (0.36) PDK2PDK4L3MBTL1
SCHEMBL3593368 0.64 PDK2 (0.34) ATAD2PDK2PDK4PGR

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
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 ATAD2 1819/4885PDK2 3637/4885PDK4 3828/4885

“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.