SCHEMBL5190685

SCHEMBL5190685

[CH2]C[CH]N1C(=O)c2ccccc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
CASP3 P42574 3/20 0.43
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
GLS O94925 1/20 0.39
POLB P06746 2/20 0.39
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP1A2 P05177 1/20 0.36
EHMT2 Q96KQ7 1/20 0.36
EHMT1 Q9H9B1 1/20 0.36

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
SCHEMBL6329301 0.78 DRD3 (0.43) ALDH1A1CASP3CA12CA9GLS
SCHEMBL2183011 0.78 CASP3 (0.40) ALDH1A1CASP3CA12CA9GLS
SCHEMBL8860266 0.75 CASP3 (0.46) ALDH1A1CASP3CA12CA9POLB
SCHEMBL5177139 0.75 DRD3 (0.44) ALDH1A1CASP3CA12CA9GLS
SCHEMBL30124938 0.75 ALDH1A1 (0.48) ALDH1A1CASP3CA12CA9GLS
SCHEMBL29372938 0.75 ALDH1A1 (0.48) ALDH1A1CASP3CA12CA9GLS
SCHEMBL35297 0.75 ALDH1A1 (0.48) ALDH1A1CASP3CA12CA9GLS
SCHEMBL20954062 0.74 POLB (0.46) ALDH1A1CASP3CA12CA9GLS
SCHEMBL30996374 0.72 POLB (0.44) ALDH1A1CASP3CA12CA9GLS
SCHEMBL238005 0.72 POLB (0.44) ALDH1A1CASP3CA12CA9GLS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197791-A1 Method for the preparation of dicarboxylic lmides SIEGFRIED LTD. (CH) 2007-08-23 US claimed
US-20070173647-A1 Method for the preparation of dicarboxylic imides SIEGFRIED LTD. (CH) 2007-07-26 US claimed
EP-1810964-A1 Process for the preparation of dicarboxylic acid imides Siegfried Ltd. (CH) 2007-07-25 EP claimed
US-20070197791-A1 Method for the preparation of dicarboxylic lmides SIEGFRIED LTD. (CH) 2007-08-23 US disclosed
US-20070173647-A1 Method for the preparation of dicarboxylic imides SIEGFRIED LTD. (CH) 2007-07-26 US disclosed
EP-1810964-A1 Process for the preparation of dicarboxylic acid imides Siegfried Ltd. (CH) 2007-07-25 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 (2 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-20070173647-A1 Method for the preparation of dicarboxylic imides RCOR3, NR2E3, FGFR3 ALDH1A1 1880/4885CASP3 608/4885CA12 204/4885
US-20070197791-A1 Method for the preparation of dicarboxylic lmides RPL3, CCNH, CCNB3 ALDH1A1 2533/4885CASP3 569/4885CA12 214/4885

“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.