SCHEMBL1708673

SCHEMBL1708673

CCc1nc2ccc(F)cc2n1-c1cccc2c1OC[C@H]2Nc1ccc2c(c1)OC[C@H]2OC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
ADORA2B P29275 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
BMI1 P35226 3/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
NTRK1 P04629 2/20 0.31
NTRK2 Q16620 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MCHR1 Q99705 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
SCHEMBL1708661 1.00 MAPT (0.33) MAPTADORA2BLMNASMN1; SMN2NPSR1
SCHEMBL1707980 0.92 ALDH1A1 (0.33) MAPTADORA2BALDH1A1MAPK1
SCHEMBL1708395 0.92 MAPT (0.32) MAPTADORA2BLMNASMN1; SMN2NPSR1
SCHEMBL1708287 0.92 MAPT (0.32) MAPTADORA2BLMNASMN1; SMN2NPSR1
SCHEMBL1708628 0.92 MAPT (0.32) MAPTADORA2BLMNASMN1; SMN2NPSR1
SCHEMBL1708620 0.91 ALDH1A1 (0.32) MAPTADORA2BALDH1A1MAPK1
SCHEMBL1708091 0.91 ADORA2B (0.31) MAPTADORA2BLMNASMN1; SMN2NPSR1
SCHEMBL1708168 0.91 NTRK1 (0.36) MAPTLMNASMN1; SMN2NPSR1BMI1
SCHEMBL1707942 0.91 NTRK1 (0.36) MAPTLMNASMN1; SMN2NPSR1BMI1
SCHEMBL1708276 0.91 MAPT (0.34) MAPTLMNASMN1; SMN2NPSR1ALDH1A1

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
EP-2440541-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-04-18 EP disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 WO disclosed