SCHEMBL6014239

SCHEMBL6014239

CCOC(=O)c1cc2cc3c(cc2nc1N(C(N)=O)c1ccccc1)OCO3

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
DHODH Q02127 1/20 0.41
PKM P14618 1/20 0.41
HSD17B10 Q99714 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MAPT P10636 3/20 0.40
NPC1 O15118 2/20 0.40
TSHR P16473 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
ALDH1A1 P00352 6/20 0.39
HPGD P15428 4/20 0.39
KDM4E B2RXH2 2/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL6014256 0.92 LMNA (0.43) LMNATDP1L3MBTL1HSD17B10SMN1; SMN2
SCHEMBL6014281 0.91 LMNA (0.42) LMNATDP1L3MBTL1PKMHSD17B10
SCHEMBL6014277 0.91 LMNA (0.42) LMNATDP1L3MBTL1PKMHSD17B10
SCHEMBL6014231 0.90 LMNA (0.42) LMNATDP1L3MBTL1HSD17B10SMN1; SMN2
SCHEMBL6014228 0.90 LMNA (0.42) LMNATDP1L3MBTL1HSD17B10SMN1; SMN2
SCHEMBL6014312 0.90 TSHR (0.44) LMNATDP1L3MBTL1HSD17B10SMN1; SMN2
SCHEMBL6014241 0.90 HTT (0.43) LMNATDP1L3MBTL1HSD17B10SMN1; SMN2
SCHEMBL6016093 0.90 ALDH1A1 (0.45) LMNATDP1PKMHSD17B10SMN1; SMN2
SCHEMBL6014297 0.89 EDNRA (0.41) LMNATDP1PKMSMN1; SMN2MAPT
SCHEMBL6014242 0.89 ALDH1A1 (0.46) LMNATDP1L3MBTL1PKMHSD17B10

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
WO-2006128268-A1 UREIDIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND THEIR USE ON THE TREATMENT OF INFLAMMATORY DISEASES UNIVERSIDADE FEDERAL DO RIO DE JANEIRO - UFRJ (BR) 2006-12-07 WO claimed
WO-2006128268-A1 UREIDIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND THEIR USE ON THE TREATMENT OF INFLAMMATORY DISEASES UNIVERSIDADE FEDERAL DO RIO DE JANEIRO - UFRJ (BR) 2006-12-07 WO disclosed