SCHEMBL7467520

SCHEMBL7467520

Cn1cc(NC(=O)c2ccccc2)cc1-c1nc2cc(C(=O)NCCNC(=O)OC(C)(C)C)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
MAPK1 P28482 1/20 0.47
BRD4 O60885 3/20 0.44
BCHE P06276 1/20 0.43
CFTR P13569 1/20 0.40
MLLT1 Q03111 1/20 0.40
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
MMP8 P22894 2/20 0.40
MMP13 P45452 2/20 0.40
COMT P21964 1/20 0.40
NAMPT P43490 4/20 0.39
POLB P06746 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
STING1 Q86WV6 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL7467474 0.88 HRAS (0.47) MAPTMAPK1BRD4BCHECFTR
Hydrochloric Acid SCHEMBL7469233 0.86 MAPT (0.50) MAPTMAPK1MMP2MMP9MMP8
Hydrochloric Acid SCHEMBL7471319 0.83 HRAS (0.48) MAPTMAPK1MMP2MMP9MMP8
SCHEMBL7477278 0.82 MAPT (0.42) MAPTMAPK1BRD4BCHEMLLT1
SCHEMBL5560010 0.82 MAPT (0.39) MAPTMAPK1BRD4NAMPTPOLB
SCHEMBL5561204 0.79 RHEB (0.41) MAPTMAPK1BRD4MMP2MMP9
SCHEMBL14879048 0.75 LCK (0.46) MAPTMAPK1POLBMEN1KMT2A
Hydrochloric Acid SCHEMBL7471999 0.74 HRAS (0.52) MAPTMAPK1CFTR
SCHEMBL7472023 0.73 HRAS (0.51) MAPTMAPK1MMP2MMP9MMP8
SCHEMBL15233045 0.72 KDM4E (0.47) MAPTMAPK1BRD4MMP2MMP9

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