SCHEMBL7470341

SCHEMBL7470341

Cn1cc([N+](=O)[O-])cc1-c1nc2cc(C(=O)NCCCN(C=O)c3ccc(N(CCCl)CCCl)cc3)ccc2[nH]1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.36
KMT2A Q03164 2/20 0.36
HRAS P01112 4/20 0.36
ESR1 P03372 4/20 0.36
ESR2 Q92731 4/20 0.36
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
FLT3 P36888 3/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
PRSS12 P56730 1/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7472733 0.89 ALDH1A1 (0.39) MAPTMEN1POLBKMT2AHRAS
SCHEMBL7460611 0.88 CNR1 (0.39) MAPTMEN1POLBKMT2AHRAS
SCHEMBL7469008 0.85 MAPT (0.50) MAPTMEN1POLBKMT2AHRAS
SCHEMBL7468134 0.84 MAPT (0.49) MAPTMEN1POLBKMT2AHRAS
SCHEMBL7470258 0.84 HPGD (0.46) MAPTMEN1POLBKMT2APRMT5
SCHEMBL7467413 0.82 MAPT (0.37) MAPTMEN1POLBKMT2AHRAS
Hydrochloric Acid SCHEMBL7464634 0.82 HRAS (0.45) HRASESR1ESR2FLT3PRSS12
SCHEMBL7463241 0.81 MAPT (0.42) MAPTMEN1POLBKMT2AHRAS
SCHEMBL7470426 0.80 MAPT (0.49) MAPTMEN1POLBKMT2AHRAS
SCHEMBL7471355 0.80 MAPT (0.43) MAPTMEN1POLBKMT2AL3MBTL1

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-0711768-B1 BENZIMIDAZOLE DERIVATIVE MITSUI CHEMICALS INC (JP) 2002-02-13 EP disclosed
EP-0711768-A1 BENZIMIDAZOLE DERIVATIVE MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-15 EP disclosed