SCHEMBL3465634

SCHEMBL3465634

c1ccc(CCCCNc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.69
ALDH1A1 P00352 1/20 0.67
MAPT P10636 1/20 0.67
SIGMAR1 Q99720 11/20 0.63
HPGD P15428 1/20 0.53
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL8100059 0.98 SIGMAR1 (0.67) L3MBTL1ALDH1A1MAPTSIGMAR1HPGD
SCHEMBL1334972 0.93 L3MBTL1 (0.72) L3MBTL1ALDH1A1MAPTSIGMAR1HPGD
Oxalic Acid SCHEMBL9374016 0.89 TRPV1 (0.57) L3MBTL1ALDH1A1MAPTSIGMAR1KMT2A
SCHEMBL28511931 0.88 SIGMAR1 (0.55) L3MBTL1ALDH1A1MAPTSIGMAR1KMT2A
SCHEMBL7835635 0.87 SIGMAR1 (0.53) L3MBTL1ALDH1A1MAPTSIGMAR1HPGD
SCHEMBL6191025 0.87 KCNH3 (0.58) L3MBTL1ALDH1A1MAPTSIGMAR1HPGD
SCHEMBL7838071 0.87 SIGMAR1 (0.53) L3MBTL1ALDH1A1MAPTSIGMAR1HPGD
SCHEMBL11791367 0.87 MAOB (0.66) L3MBTL1ALDH1A1MAPTSIGMAR1KMT2A
SCHEMBL4970157 0.86 ALDH1A1 (0.89) L3MBTL1ALDH1A1MAPT
SCHEMBL295159 0.85 MAOB (0.63) L3MBTL1ALDH1A1MAPTSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767690-B2 Amino alcohol derivatives and their use as renin inhibitor NOVARTIS AG (CH) 2010-08-03 US disclosed
US-20090118281-A1 Amino Alcohol Derivatives And Their Use As Renin Inhibitor NOVARTIS AG (CH) 2009-05-07 US disclosed
US-20070021400-A1 Amino alcohols as therapeutic compounds SPEEDEL EXPERIMENTA AG (CH) 2007-01-25 US disclosed
EP-1745776-A1 Aminoalcohols as therapeutic compounds Speedel Experimenta AG (CH) 2007-01-24 EP disclosed
EP-1711456-A2 AMINO ALCOHOL DERIVATIVES AND THEIR USE AS RENIN INHIBITORS Speedel Experimenta AG (CH) 2006-10-18 EP disclosed
WO-2005070870-A2 AMINO ALCOHOL DERIVATIVES AND THEIR USE AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2005-08-04 WO disclosed
WO-1998037084-A1 3-SUBSTITUTED CLAVAMS FOR CALPAIN INHIBITION SMITHKLINE BEECHAM CORPORATION (US) 1998-08-27 WO disclosed
US-5719141-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-02-17 US disclosed
EP-0702004-A2 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives CIBA-GEIGY AG (CH) 1996-03-20 EP disclosed
US-4734490-A TEXTILE DYEING AND PRINTING CIBA-GEIGY CORPORATION (US) 1988-03-29 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-20090118281-A1 Amino Alcohol Derivatives And Their Use As Renin Inhibitor REN, AGTR1, ADH1A L3MBTL1 3039/4885ALDH1A1 161/4885MAPT 2542/4885
US-20070021400-A1 Amino alcohols as therapeutic compounds CTSL, CTSD, CTSS L3MBTL1 481/4885ALDH1A1 279/4885MAPT 621/4885

“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.