SCHEMBL3038752

SCHEMBL3038752

COc1cc(NC(=O)Cn2cnc3cccc(C#N)c32)cc(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.46
LMNA P02545 2/20 0.45
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 2/20 0.45
CSF1R P07333 1/20 0.44
PDGFRB P09619 1/20 0.44
FLT4 P35916 1/20 0.44
FLT3 P36888 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 3/20 0.43
KMT2A Q03164 2/20 0.43
CDYL2 Q8N8U2 1/20 0.43
CDYL Q9Y232 1/20 0.43
CDY1; CDY1B Q9Y6F8 1/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
TP53 P04637 1/20 0.43
ACHE P22303 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL3042146 0.93 CSF1R (0.51) POLBALDH1A1KDM4ECSF1RPDGFRB
SCHEMBL4975309 0.91 POLB (0.46) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL4974551 0.90 POLB (0.45) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL4979239 0.88 MAPT (0.55) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL4975792 0.87 POLB (0.54) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL3045782 0.86 SMN1; SMN2 (0.51) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL4974094 0.86 LMNA (0.48) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL4979213 0.86 HTT (0.59) POLBLMNAALDH1A1KDM4ECSF1R
SCHEMBL3042993 0.85 POLB (0.48) POLBLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL3041004 0.85 MAPT (0.48) POLBLMNAALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645784-B2 Benzimidazole derivatives ASTRAZENECA AB (SE) 2010-01-12 US claimed
EP-2042490-A2 Benzimidazole derivatives as vanilloid receptor antagonists AstraZeneca AB (SE) 2009-04-01 EP claimed
EP-1626964-B1 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2009-01-21 EP claimed
US-20060287377-A1 New benzimidazole derivatives ASTRAZENECA AB (SE) 2006-12-21 US claimed
EP-1626964-A2 NEW BENZIMIDAZOLE DERIVATIVES AstraZeneca AB (SE) 2006-02-22 EP claimed
WO-2004100865-A2 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-11-25 WO claimed
US-7645784-B2 Benzimidazole derivatives ASTRAZENECA AB (SE) 2010-01-12 US disclosed
EP-2042490-A2 Benzimidazole derivatives as vanilloid receptor antagonists AstraZeneca AB (SE) 2009-04-01 EP disclosed
EP-1626964-B1 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2009-01-21 EP disclosed
US-20060287377-A1 New benzimidazole derivatives ASTRAZENECA AB (SE) 2006-12-21 US disclosed
EP-1626964-A2 NEW BENZIMIDAZOLE DERIVATIVES AstraZeneca AB (SE) 2006-02-22 EP disclosed
WO-2004100865-A2 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-11-25 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 (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-20060287377-A1 New benzimidazole derivatives CYP2C9, CDK9, CCNI POLB 746/4885LMNA 671/4885ALDH1A1 668/4885

“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.