SCHEMBL5606358

SCHEMBL5606358

FC(F)(F)c1cccc(CCNc2n[c]ccn2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.44
RXFP1 Q9HBX9 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ROCK1 Q13464 1/20 0.43
NR3C2 P08235 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
CNR1 P21554 1/20 0.40

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
SCHEMBL5597057 0.80 HPGD (0.54) TAAR1LMNAMEN1MAPTHPGD
SCHEMBL5596291 0.75 OGA (0.51) L3MBTL1HDAC3HDAC1HDAC2HDAC6
SCHEMBL5543319 0.74 TAAR1 (0.53) TAAR1RXFP1LMNAMEN1ALDH1A1
SCHEMBL5596251 0.72 HPGD (0.45) TAAR1MEN1HPGDKMT2AHDAC3
SCHEMBL27537248 0.72 GFER (0.38) HPGDHDAC3HDAC1HDAC2HDAC6
SCHEMBL7014068 0.71 HTR7 (0.51) RXFP1LMNAMEN1ALDH1A1MAPT
SCHEMBL5596807 0.71 LMNA (0.59) LMNAMEN1ALDH1A1MAPTKMT2A
Hydrochloric Acid SCHEMBL27770501 0.70 TAAR1 (0.62) TAAR1LMNAMEN1MAPTKMT2A
SCHEMBL15432467 0.69 TAAR1 (0.57) TAAR1LMNAMEN1MAPTHTT
SCHEMBL5596745 0.69 POLB (0.45) RXFP1LMNAMEN1ALDH1A1MAPT

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
EP-1696909-B1 BENZOTHIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES SERONO LAB (CH) 2007-11-14 EP claimed