SCHEMBL3534675

SCHEMBL3534675

CCN1CCN(c2ccc([N+](=O)[O-])c(CN)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
SIRT6 Q8N6T7 3/20 0.51
LMNA P02545 3/20 0.49
OPRM1 P35372 1/20 0.49
OPRD1 P41143 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPK1 P28482 1/20 0.49
GAA P10253 2/20 0.48
RAD52 P43351 2/20 0.48
HPGD P15428 1/20 0.47
KDM4E B2RXH2 1/20 0.47
GFER P55789 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL5237295 0.86 SIRT6 (0.68) MAPTSIRT6L3MBTL1MAPK1ALDH1A1
SCHEMBL4772717 0.84 MAPT (0.72) MAPTSIRT6LMNAOPRM1OPRD1
SCHEMBL10812653 0.83 LMNA (0.64) MAPTLMNAL3MBTL1MAPK1HPGD
SCHEMBL4723486 0.81 L3MBTL1 (0.51) MAPTSIRT6LMNAOPRM1OPRD1
SCHEMBL22652221 0.81 L3MBTL1 (0.51) MAPTSIRT6LMNAOPRM1OPRD1
SCHEMBL16654429 0.81 GAA (0.61) MAPTSIRT6LMNAOPRM1OPRD1
SCHEMBL30679043 0.81 SIRT6 (0.72) MAPTSIRT6LMNAOPRM1OPRD1
SCHEMBL4762192 0.81 MAPT (0.57) MAPTSIRT6LMNAOPRM1OPRD1
Hydrochloric Acid SCHEMBL28515207 0.80 GAA (0.59) MAPTSIRT6LMNAOPRM1OPRD1
SCHEMBL2927491 0.80 GAA (0.55) MAPTSIRT6LMNAOPRM1OPRD1

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-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-20060079564-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2006-04-13 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-20060079564-A1 Indazole benzimidazole compounds ABL1, ABL2, ALK MAPT 19/4885SIRT6 4196/4885LMNA 2670/4885

“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.