SCHEMBL2329657

SCHEMBL2329657

O=[N+]([O-])c1ccc(O)cc1Nc1ccc2ccccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.58
KMT2A Q03164 8/20 0.58
MAPT P10636 6/20 0.58
TDP1 Q9NUW8 4/20 0.58
MAPK1 P28482 3/20 0.58
GAA P10253 3/20 0.58
PKM P14618 1/20 0.58
ALDH1A1 P00352 5/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HTT P42858 2/20 0.45
POLB P06746 1/20 0.45
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
CASP7 P55210 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
CTSV O60911 1/20 0.45
CTSL P07711 1/20 0.45
NPC1 O15118 3/20 0.44

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
SCHEMBL5408865 0.84 MEN1 (0.67) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL497083 0.84 ALDH1A1 (0.65) MEN1KMT2AMAPTTDP1MAPK1
Ammonia Solution, Strong SCHEMBL27767104 0.82 ALDH1A1 (0.63) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL2326905 0.79 SMN1; SMN2 (0.57) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL6651601 0.78 KMT2A (0.59) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL2208981 0.78 MAPT (0.59) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL2330319 0.78 MAPT (0.61) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL2330420 0.77 MAPT (0.62) MEN1KMT2AMAPTPOLBHPGD
SCHEMBL2327958 0.77 MAPK1 (0.51) MEN1KMT2AMAPTTDP1MAPK1
SCHEMBL2332988 0.76 FBP1 (0.59) MEN1KMT2AMAPTTDP1MAPK1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1246808-B1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION BAYER SCHERING PHARMA AG (DE) 2011-08-17 EP disclosed
US-7345075-B2 6-[(1,2-diphenyl-1H-benzimidazol-6-yl)oxy]hexanoic acid isopropyl ester; antiinflammatory agents; microglia activators; neurodegenerative diseases SCHERING AKTIENGESELLSCHAFT (DE) 2008-03-18 US disclosed
US-7329679-B2 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2008-02-12 US disclosed
CN-1301975-C 1,2-diaryl benzimidazole derivative for treating illnesses associated with microglia activation SCHERING AG (DE) 2007-02-28 CN disclosed
US-7115645-B2 1,2 diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-10-03 US disclosed
US-20060205803-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-09-14 US disclosed
US-20060094770-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-05-04 US disclosed
CN-1395568-A 1,2-diaryl benzimidazole derivative for treating illnesses associated with microglia activation SCHERING AG (DE) 2003-02-05 CN disclosed
EP-1246808-A1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION SCHERING AKTIENGESELLSCHAFT (DE) 2002-10-09 EP disclosed
US-20020006948-A1 1,2 diarylbenzimdazoles and their pharmaceutical use SCHERING AG 2002-01-17 US disclosed
WO-2001051473-A1 1,2-DIARYL BENZIMIDAZOLES FOR TREATING ILLNESSES ASSOCIATED WITH A MICROGLIA ACTIVATION SCHERING AKTIENGESELLSCHAFT (DE) 2001-07-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020006948-A1 1,2 diarylbenzimdazoles and their pharmaceutical use CYP2E1, CYP1B1, CYP1A1 MEN1 3010/4885KMT2A 3421/4885MAPT 1799/4885
US-20060094770-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use ATP6V1B2, IL1B, GMFG MEN1 3216/4885KMT2A 2759/4885MAPT 829/4885
US-20060205803-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use ATP6V1B2, IL1B, GMFG MEN1 3216/4885KMT2A 2759/4885MAPT 829/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.