SCHEMBL4588933

SCHEMBL4588933

COc1ccc(S(=O)(=O)N(c2ccc3c(c2)nc(-c2ccccc2)n3-c2ccccc2)S(=O)(=O)c2ccc(OC)cc2)cc1.COc1ccc(S(=O)(=O)Nc2ccc3c(c2)nc(-c2ccccc2)n3-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
PTPN2 P17706 4/20 0.50
PTPN1 P18031 4/20 0.50
PTPN5 P54829 4/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
HPGD P15428 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 1/20 0.47
ALOX12 P18054 1/20 0.47
NPY5R Q15761 1/20 0.45
TP53 P04637 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PLAU P00749 1/20 0.43
POLB P06746 1/20 0.43
PKM P14618 2/20 0.43
TRIM24 O15164 1/20 0.43
PGR P06401 1/20 0.42
CYP19A1 P11511 1/20 0.42

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
SCHEMBL2326320 0.91 MAPT (0.58) MAPTPTPN2PTPN1PTPN5HTT
SCHEMBL2329102 0.91 SIRT2 (0.46) HTTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL2330704 0.85 MAPT (0.56) MAPTPTPN2PTPN1PTPN5HTT
SCHEMBL4589934 0.81 PTPN2 (0.57) MAPTPTPN2PTPN1PTPN5HTT
SCHEMBL2330847 0.81 SIRT2 (0.50) HTTALDH1A1LMNAL3MBTL1GAA
SCHEMBL2330377 0.81 HPGD (0.52) MAPTPTPN2PTPN1PTPN5HTT
SCHEMBL2333148 0.81 SIRT2 (0.47) MAPTALDH1A1GAASMN1; SMN2
SCHEMBL2331010 0.79 PTPN2 (0.56) MAPTPTPN2PTPN1PTPN5HTT
SCHEMBL2326870 0.79 SIRT2 (0.44) ALDH1A1LMNAGAAATM
SCHEMBL2326303 0.79 PTPN2 (0.56) MAPTPTPN2PTPN1PTPN5HTT

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-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-20060205803-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 2006-09-14 US 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 (1 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-20060205803-A1 1,2 Diarylbenzimidazoles and their pharmaceutical use ATP6V1B2, IL1B, GMFG MAPT 829/4885PTPN2 1930/4885PTPN1 2216/4885

“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.