SCHEMBL3535156

SCHEMBL3535156

C[C@H]1CN(c2ccc([N+](=O)[O-])c(N)c2)CCN1C

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.67
SIRT6 Q8N6T7 5/20 0.67
LMNA P02545 2/20 0.60
RECQL P46063 1/20 0.56
HTR7 P34969 1/20 0.47
ALDH1A1 P00352 3/20 0.44
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.41
HTR6 P50406 2/20 0.41

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
SCHEMBL3535158 1.00 MAPT (0.67) MAPTSIRT6LMNARECQLHTR7
SCHEMBL20293508 0.85 MAPT (0.64) MAPTSIRT6LMNARECQLHTR7
SCHEMBL23072835 0.85 MAPT (0.64) MAPTSIRT6LMNARECQLHTR7
SCHEMBL30565923 0.85 MAPT (0.64) MAPTSIRT6LMNARECQLHTR7
SCHEMBL15995584 0.82 SIRT6 (0.69) MAPTSIRT6LMNAALDH1A1HPGD
SCHEMBL3540826 0.81 MAPT (0.59) MAPTSIRT6LMNARECQLHTR7
SCHEMBL77148 0.81 SIRT6 (1.00) MAPTSIRT6LMNARECQLALDH1A1
SCHEMBL3535324 0.81 MAPT (0.45) MAPTSIRT6RECQLMAPK1
SCHEMBL3535320 0.81 MAPT (0.45) MAPTSIRT6RECQLMAPK1
SCHEMBL6887531 0.80 SIRT6 (0.54) MAPTSIRT6ALDH1A1HPGDL3MBTL1

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 5 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-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-7064215-B2 Indazole benzimidazole compounds CHIRON CORPORATION (US) 2006-06-20 US disclosed
US-20060079564-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2006-04-13 US disclosed
US-20030207883-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2003-11-06 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 (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-20060079564-A1 Indazole benzimidazole compounds ABL1, ABL2, ALK MAPT 19/4885SIRT6 4196/4885LMNA 2670/4885
US-20030207883-A1 Indazole benzimidazole compounds SLCO1B3, SLCO1B1, SLCO4C1 MAPT 1127/4885SIRT6 2043/4885LMNA 3372/4885

“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.