SCHEMBL4065824

SCHEMBL4065824

NC1Cc2ccccc2N(CC(=O)NCc2ccccn2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
USP2 O75604 1/20 0.47
AADAT Q8N5Z0 2/20 0.47
GOT1 P17174 1/20 0.47
KYAT1 Q16773 1/20 0.47
KYAT3 Q6YP21 1/20 0.47
ALOX15 P16050 2/20 0.47
PKM P14618 1/20 0.47
YWHAG P61981 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KAT2A Q92830 1/20 0.47
KAT2B Q92831 1/20 0.47
ALDH1A1 P00352 1/20 0.46
HPGD P15428 2/20 0.46
RECQL P46063 1/20 0.46
TSHR P16473 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.44

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
SCHEMBL4065818 0.88 KDM4E (0.53) KDM4EUSP2ALOX15PKMYWHAG
SCHEMBL4067888 0.80 PYGL (0.54) KDM4EAADATGOT1KYAT1KYAT3
SCHEMBL4073290 0.78 AADAT (0.48) KDM4EAADATGOT1KYAT1KYAT3
SCHEMBL4066129 0.76 AADAT (0.46) KDM4EAADATGOT1KYAT1KYAT3
SCHEMBL4073194 0.76 KDM4E (0.62) KDM4EAADATGOT1KYAT1KYAT3
SCHEMBL4891481 0.75 AADAT (0.59) AADATGOT1KYAT1KYAT3
SCHEMBL5641958 0.75 PYGL (0.80)
SCHEMBL13878939 0.74 PYGL (0.65)
SCHEMBL4068094 0.74 POLB (0.44) KDM4EAADATGOT1KYAT1KYAT3
SCHEMBL4065939 0.73 AADAT (0.54) AADATGOT1KYAT1KYAT3POLB

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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LIMITED (GB) 2009-04-16 US disclosed
EP-1819332-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LTD (GB) 2009-03-11 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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PC, GOT2, PDK1 KDM4E 3425/4885USP2 2981/4885AADAT 426/4885

“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.