SCHEMBL4027334

SCHEMBL4027334

NC(=O)[CH]CCn1cccc1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MAP3K14 Q99558 1/20 0.46
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
ADRA1D P25100 1/20 0.36
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CNR2 P34972 1/20 0.32
GAA P10253 1/20 0.31
MAOB P27338 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
SCHEMBL27611348 0.80 LMNA (0.53) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL29102668 0.77 LMNA (0.50) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL27840672 0.74 LMNA (0.47) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL11022537 0.72 LMNA (0.46) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL6823635 0.72 LMNA (0.46) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL4427821 0.72 LMNA (0.53) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL29038553 0.71 ICMT (0.48) LMNAMAP3K14KDM4EMEN1MAPT
SCHEMBL28137548 0.71 ICMT (0.48) LMNAMAP3K14KDM4EMEN1MAPT
SCHEMBL27817843 0.70 KDM4E (0.46) LMNAMAP3K14KDM4EALDH1A1MEN1
SCHEMBL7489244 0.70 TP53 (0.37) MEN1KMT2A

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-1261601-B1 SUBSTITUTED INDOLES FOR MODULATING NFKB ACTIVITY SANOFI AVENTIS DEUTSCHLAND (DE) 2009-07-29 EP disclosed