SCHEMBL6849519

SCHEMBL6849519

CC(C)(C)c1cc(C(=O)Cn2c(-c3ccccc3)cn(Cc3ccccc3)c2=N)cc(C(C)(C)C)c1O

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2R P25116 10/20 0.66
MAOB P27338 4/20 0.46
BCHE P06276 2/20 0.45
MAOA P21397 2/20 0.45
ACHE P22303 2/20 0.45
TNFRSF1A P19438 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 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
Bromide SCHEMBL5585203 0.99 F2R (0.65) F2RMAOBBCHEMAOAACHE
SCHEMBL14346249 0.90 F2R (0.69) F2RMAOBBCHEMAOAACHE
Bromide SCHEMBL4351865 0.89 F2R (0.67) F2RMAOBBCHEMAOAACHE
SCHEMBL14346256 0.87 F2R (0.67) F2RMAOBBCHEMAOAACHE
Bromide SCHEMBL4340591 0.86 F2R (0.66) F2RMAOBBCHEMAOAACHE
SCHEMBL14368562 0.85 F2R (0.55) F2RMAOBBCHEMAOAACHE
SCHEMBL14346324 0.84 F2R (0.64) F2RMAOBBCHEMAOAACHE
SCHEMBL14346327 0.84 F2R (0.64) F2RMAOBBCHEMAOAACHE
Bromide SCHEMBL4347358 0.83 F2R (0.63) F2RMAOBBCHEMAOAACHE
SCHEMBL14346287 0.83 F2R (0.63) F2RMAOBBCHEMAOAACHE

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
US-7304083-B2 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-12-04 US disclosed
EP-1391456-A1 2-IMINOIMIDAZOLE DERIVATIVE (2) Eisai Co., Ltd. (JP) 2004-02-25 EP disclosed