SCHEMBL6014303

SCHEMBL6014303

CCOC(=O)c1cc2cc3c(cc2nc1N(C(N)=O)c1c(F)cccc1F)OCO3

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 3/20 0.39
HSD17B10 Q99714 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
KDM4E B2RXH2 3/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
JAK2 O60674 1/20 0.37
JAK3 P52333 1/20 0.37
TP53 P04637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TGFBR1 P36897 1/20 0.36
MAPK14 Q16539 2/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL6014273 0.89 LMNA (0.41) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014312 0.86 TSHR (0.44) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014239 0.86 LMNA (0.43) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014256 0.84 LMNA (0.43) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014241 0.84 HTT (0.43) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014281 0.83 LMNA (0.42) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014277 0.83 LMNA (0.42) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014266 0.83 LMNA (0.39) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014304 0.83 ALDH1A1 (0.41) LMNATDP1TSHRHSD17B10SMN1; SMN2
SCHEMBL6014231 0.82 LMNA (0.42) LMNATDP1TSHRHSD17B10SMN1; SMN2

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