SCHEMBL6012006

SCHEMBL6012006

CC(Br)C(=O)Br.CC(Br)C(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
CYP1A2 P05177 1/20 0.56
POLB P06746 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
TP53 P04637 2/20 0.56
MAPT P10636 4/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 1/20 0.55
LMNA P02545 3/20 0.52
GAA P10253 2/20 0.51
XBP1 P17861 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL3034787 0.96 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL3045463 0.84 MAPT (0.56) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL5561958 0.84 SMN1; SMN2 (0.63) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL31093984 0.84 SMN1; SMN2 (0.63) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL5133570 0.82 SMN1; SMN2 (0.62) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL963688 0.82 SMN1; SMN2 (0.62) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL28733093 0.82 MAPT (0.60) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL23733551 0.81 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL12251335 0.81 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL19638131 0.81 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A

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-1626964-A2 NEW BENZIMIDAZOLE DERIVATIVES AstraZeneca AB (SE) 2006-02-22 EP disclosed
WO-2004100865-A2 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-11-25 WO disclosed