SCHEMBL6073029

SCHEMBL6073029

NC(=O)[C@H](/N=C/c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
GRIN2D O15399 2/20 0.44
GRIN3B O60391 2/20 0.44
GRIN1 Q05586 2/20 0.44
GRIN2A Q12879 2/20 0.44
GRIN2B Q13224 2/20 0.44
GRIN2C Q14957 2/20 0.44
GRIN3A Q8TCU5 2/20 0.44
TAAR1 Q96RJ0 1/20 0.44
PLA2G7 Q13093 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 2/20 0.41
EPHX1 P07099 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CA1 P00915 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
SCHEMBL9788843 1.00 LMNA (0.45) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL11543708 1.00 LMNA (0.45) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL6073037 1.00 LMNA (0.45) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL6073034 1.00 LMNA (0.45) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL23835356 0.87 CYP1A2 (0.46) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL23835355 0.87 CYP1A2 (0.46) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL11537365 0.85 RAB9A (0.51) KDM4EALDH1A1MAPTGRIN2DGRIN3B
SCHEMBL2984290 0.80 KMT2A (0.51) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL2984292 0.80 KMT2A (0.51) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL9734293 0.80 KMT2A (0.51) LMNAALDH1A1MAPTHPGDMEN1

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
WO-2006069798-A1 PROCESS FOR THE PREPARATION OF CHIRAL AMINES DSM IP ASSETS B.V. (NL) 2006-07-06 WO disclosed