SCHEMBL3538700

SCHEMBL3538700

Nc1ccc(N2CCC3(CC2)OCCO3)cc1N

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 4/20 0.69
MAPT P10636 3/20 0.41
GAA P10253 3/20 0.41
ALDH1A1 P00352 3/20 0.41
S100B P04271 2/20 0.41
MAPK1 P28482 2/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
ALOX15 P16050 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
F12 P00748 1/20 0.40
KDM4E B2RXH2 2/20 0.39
RECQL P46063 1/20 0.39
PTK2B Q14289 1/20 0.39
IP6K1 Q92551 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL14866236 0.86 LGMN (0.64) LGMNMAPTGAAALDH1A1S100B
SCHEMBL26113530 0.84 LGMN (0.59) LGMNMAPTGAAALDH1A1S100B
SCHEMBL520465 0.82 LGMN (0.60) LGMNMAPTALDH1A1HTTLMNA
SCHEMBL1982163 0.81 LGMN (0.61) LGMNMAPTGAAALDH1A1MAPK1
SCHEMBL3541728 0.80 LMNA (0.66) LGMNMAPTGAAALDH1A1MAPK1
SCHEMBL12862609 0.79 LGMN (0.56) LGMNMAPTGAAALDH1A1S100B
SCHEMBL14981268 0.77 LGMN (0.54) LGMNMAPTGAAALDH1A1S100B
SCHEMBL904452 0.77 LGMN (0.73) LGMNMAPTGAAALDH1A1S100B
SCHEMBL23123183 0.77 LGMN (0.47) LGMNMAPTGAAALDH1A1S100B
SCHEMBL4169525 0.77 LGMN (0.54) LGMNMAPTGAAALDH1A1MAPK1

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 6 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-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 LGMN 3246/4885MAPT 19/4885GAA 1060/4885
US-20030207883-A1 Indazole benzimidazole compounds SLCO1B3, SLCO1B1, SLCO4C1 LGMN 4650/4885MAPT 1127/4885GAA 194/4885

“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.