SCHEMBL4066129

SCHEMBL4066129

CN(C)CCNC(=O)CN1C(=O)C(N)Cc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 2/20 0.46
GOT1 P17174 1/20 0.46
KYAT1 Q16773 1/20 0.46
KYAT3 Q6YP21 1/20 0.46
LMNA P02545 1/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 0.43
PYGL P06737 1/20 0.43
LGALS1 P09382 1/20 0.42
TSHR P16473 2/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
TP53 P04637 3/20 0.41
MAPT P10636 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CACNA1S Q13698 2/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL4066125 0.87 LMNA (0.42) LMNAALDH1A1KDM4EGAAPYGL
SCHEMBL4067888 0.86 PYGL (0.54) AADATGOT1KYAT1KYAT3ALDH1A1
SCHEMBL4073194 0.84 KDM4E (0.62) AADATGOT1KYAT1KYAT3ALDH1A1
SCHEMBL13749492 0.83 LMNA (0.41) LMNAALDH1A1KDM4EGAAPYGL
SCHEMBL4073290 0.82 AADAT (0.48) AADATGOT1KYAT1KYAT3ALDH1A1
SCHEMBL4064792 0.80 AADAT (0.54) AADATGOT1KYAT1KYAT3PYGL
SCHEMBL5629416 0.80 CACNA1S (0.57) AADATGOT1KYAT1KYAT3LMNA
SCHEMBL4065939 0.77 AADAT (0.54) AADATGOT1KYAT1KYAT3LMNA
SCHEMBL4064371 0.77 AADAT (0.54) AADATGOT1KYAT1KYAT3LMNA
SCHEMBL4064369 0.77 AADAT (0.54) AADATGOT1KYAT1KYAT3LMNA

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
EP-1819332-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LTD (GB) 2009-03-11 EP disclosed