SCHEMBL7066677

SCHEMBL7066677

COc1cc(Cl)c(C)cc1NC(=O)NCC(C)(C)CC(=O)N(CC(=O)NO)CC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 5/20 0.38
MAPT P10636 4/20 0.38
LMNA P02545 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
GAA P10253 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 2/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL6825607 0.98 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1
SCHEMBL6825489 0.93 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1
SCHEMBL6825402 0.89 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL6822142 0.87 KMT2A (0.49) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL6822296 0.86 KMT2A (0.41) SMN1; SMN2ALDH1A1MAPTLMNAHTT
SCHEMBL6822411 0.85 TDP1 (0.45) SMN1; SMN2ALDH1A1LMNAL3MBTL1TSHR
SCHEMBL6825420 0.84 LMNA (0.40) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1
SCHEMBL6827634 0.84 KMT2A (0.42) SMN1; SMN2ALDH1A1MAPTL3MBTL1GAA
SCHEMBL6825191 0.84 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1
SCHEMBL6824838 0.84 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1

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-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed