SCHEMBL4968521

SCHEMBL4968521

CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(NCCO[Si](C)(C)C(C)(C)C)c(NC(=O)C(C)(C)C)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
LMNA P02545 7/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
MAPK1 P28482 2/20 0.44
HTT P42858 2/20 0.44
ALOX15 P16050 1/20 0.44
PKM P14618 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL4966298 0.95 KDM4E (0.53) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL4967663 0.87 KDM4E (0.46) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL4970637 0.85 PKM (0.56) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL4971230 0.83 LMNA (0.46) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL14116641 0.82 KDM4E (0.54) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL14116640 0.81 KDM4E (0.53) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL4970011 0.80 PKM (0.56) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL5722710 0.79 MAPT (0.59) KDM4ELMNAMAPK1HTTPKM
SCHEMBL4966160 0.79 KDM4E (0.53) KDM4ELMNASMN1; SMN2MAPK1HTT
SCHEMBL4966207 0.75 KDM4E (0.69) KDM4ELMNASMN1; SMN2MAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670770-B1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEROF AND USES THEREOF ASTRAZENECA AB (SE) 2008-08-20 EP disclosed
US-20070082899-A1 Benzimidazole derivatives, compositions containing them, preparation thereof and uses thereof ASTRAZENECA AB (SE) 2007-04-12 US disclosed
US-20070082899-A1 Benzimidazole derivatives, compositions containing them, preparation thereof and uses thereof ASTRAZENECA AB (SE) 2007-04-12 US disclosed
US-20070072853-A1 Benzimidazole derivatives compositions containing them, preparation thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-29 US disclosed
US-20070072853-A1 Benzimidazole derivatives compositions containing them, preparation thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-29 US disclosed
EP-1673369-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-06-28 EP disclosed
EP-1670770-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEROF AND USES THEREOF AstraZeneca AB (SE) 2006-06-21 EP disclosed
WO-2005030761-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2005-04-07 WO disclosed
WO-2005030733-A1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEROF AND USES THEREOF ASTRAZENECA AB (SE) 2005-04-07 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 (2 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-20070082899-A1 Benzimidazole derivatives, compositions containing them, preparation thereof and uses thereof F12, H1-3, H1-4 KDM4E 1841/4885LMNA 2120/4885SMN1; SMN2 1918/4885
US-20070072853-A1 Benzimidazole derivatives compositions containing them, preparation thereof and uses thereof RB1, CYP2C19, ADRB3 KDM4E 2030/4885LMNA 1900/4885SMN1; SMN2 1109/4885

“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.