SCHEMBL10147594

SCHEMBL10147594

O=C(NCCc1ccc2c(c1)OCO2)C1Cc2ccccc2CN1CC1C=C2OCOC2=CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.46
LMNA P02545 2/20 0.41
FAAH O00519 4/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ROCK2 O75116 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
NOS2 P35228 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2601969 0.84 NAMPT (0.53) NAMPTLMNAFAAHTSHRMAPK1
SCHEMBL3562002 0.74 PTPN1 (0.58) NAMPTLMNATSHRMAPK1ALDH1A1
SCHEMBL13074367 0.70 MEN1 (0.59) NAMPTLMNAFAAHTSHRMAPK1
SCHEMBL13037186 0.70 MEN1 (0.59) NAMPTLMNAFAAHTSHRMAPK1
SCHEMBL13037189 0.67 NOS2 (0.57) NAMPTNOS2
SCHEMBL29407510 0.67 TSHR (0.65) LMNAFAAHTSHRMAPK1NPC1
SCHEMBL3378134 0.67 TSHR (0.65) LMNAFAAHTSHRMAPK1NPC1
SCHEMBL107447 0.66 PPARD (0.46) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL4649730 0.66 NAMPT (0.42) NAMPTTSHRMAPK1ALDH1A1HPGD
SCHEMBL927331 0.66 ALDH1A1 (0.50) NAMPTLMNATSHRMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120225890-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES SUCH AS ALZHEIMER'S DISEASE, TYPE 2 DIABETES AND PARKINSON'S DISEASE PROTAMED, INC. 2012-09-06 US disclosed
US-8163957-B2 Compounds, compositions and methods for the treatment of amyloid diseases and synucleinopathies such as alzheimer's disease, type 2 diabetes and parkinson's disease PROTEOTECH, INC. (US) 2012-04-24 US disclosed
US-20110172239-A1 Compounds, Compositions and Methods for the Treatment of Amyloid Diseases and Synucleinopathies such as Alzheimer's Disease, Type 2 Diabetes and Parkinson's Disease PROTAMED, INC. 2011-07-14 US disclosed
US-7919530-B2 Compounds, compositions, and methods for the treatment of synucleinopathies PROTEOTECH, INC. (US) 2011-04-05 US disclosed
US-20100179223-A1 Compounds, Compositions, and Methods for the Treatment of Synucleinopathies PROTAMED, INC. 2010-07-15 US disclosed
US-20090197965-A1 Bis- and tris-dihydroxyaryl compounds and their methylenedioxy analogs; Alzheimer's disease; diabetes; A beta amyloidosis SNOW ALAN D 2009-08-06 US disclosed
US-7514583-B2 bis- and tris-dihydroxyaryl compounds and their methylenedioxy analogs; treatment of A beta , IAPP, other amyloids, and alpha -synuclein or NAC fibrillogenesis PROTEOTECH, INC. (US) 2009-04-07 US disclosed
US-20070208087-A1 Compounds, compositions and methods for the treatment of inflammatory diseases PROTEOTECH INC. 2007-09-06 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 (5 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-20100179223-A1 Compounds, Compositions, and Methods for the Treatment of Synucleinopathies SNCA, PARK7, COMT NAMPT 2815/4885LMNA 832/4885FAAH 968/4885
US-20090197965-A1 Bis- and tris-dihydroxyaryl compounds and their methylenedioxy analogs; Alzheimer's disease; diabetes; A beta amyloidosis IAPP, APP, SNCA NAMPT 2451/4885LMNA 1220/4885FAAH 1466/4885
US-20120225890-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES SUCH AS ALZHEIMER'S DISEASE, TYPE 2 DIABETES AND PARKINSON'S DISEASE IAPP, SNCA, APP NAMPT 1756/4885LMNA 1113/4885FAAH 1619/4885
US-20070208087-A1 Compounds, compositions and methods for the treatment of inflammatory diseases NR1H2, NR1H3, NR1H4 NAMPT 2073/4885LMNA 2039/4885FAAH 444/4885
US-20110172239-A1 Compounds, Compositions and Methods for the Treatment of Amyloid Diseases and Synucleinopathies such as Alzheimer's Disease, Type 2 Diabetes and Parkinson's Disease IAPP, SNCA, APP NAMPT 1756/4885LMNA 1113/4885FAAH 1619/4885

“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.