SCHEMBL28079197

SCHEMBL28079197

CC(C(=O)CONC=O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
TSHR P16473 1/20 0.47
ALDH1A1 P00352 4/20 0.47
HTT P42858 3/20 0.46
POLB P06746 2/20 0.45
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL11453215 0.76 LMNA (0.54) LMNAALDH1A1HTTPOLBKMT2A
SCHEMBL2821892 0.75 LMNA (0.60) LMNATSHRALDH1A1HTTPOLB
SCHEMBL28536859 0.73 LMNA (0.58) LMNATSHRALDH1A1HTTPOLB
SCHEMBL22556269 0.73 TP53 (0.40) LMNATSHRALDH1A1HTTPOLB
SCHEMBL29016758 0.73 TDP1 (0.42) LMNATSHRALDH1A1KMT2AMAPT
SCHEMBL28016614 0.71 ALDH1A1 (0.67) LMNATSHRALDH1A1HTTPOLB
SCHEMBL5839153 0.71 LMNA (0.60) LMNAALDH1A1HTTPOLBKMT2A
SCHEMBL22408859 0.71 LMNA (0.49) LMNAALDH1A1HTTPOLBKMT2A
SCHEMBL22408858 0.71 LMNA (0.49) LMNAALDH1A1HTTPOLBKMT2A
SCHEMBL10577708 0.70 LMNA (0.68) LMNATSHRALDH1A1HTTPOLB

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
CN-105669525-A Synthetic method of N-((2-(1,3-dioxo-dihydroisoindol-2-yl)-propionyl)-5-methoxy)formamide 苏州艾缇克药物化学有限公司 2016-06-15 CN disclosed