SCHEMBL3197069

SCHEMBL3197069

CN1CCN(c2ccc(N)c(C=O)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
KDM4E B2RXH2 4/20 0.61
GAA P10253 4/20 0.61
PTK2B Q14289 2/20 0.61
MAPK1 P28482 1/20 0.61
HTT P42858 1/20 0.61
RECQL P46063 1/20 0.61
ALDH1A1 P00352 3/20 0.56
SIRT6 Q8N6T7 3/20 0.52
ADRA2C P18825 3/20 0.51
KMT2A Q03164 2/20 0.51
GFER P55789 1/20 0.51
ESR2 Q92731 1/20 0.51
MEN1 O00255 1/20 0.47
GLA P06280 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTR3A P46098 1/20 0.46
RAD52 P43351 1/20 0.42

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
SCHEMBL5753256 0.82 MAPT (0.51) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL12357055 0.81 GAA (0.43) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL3208009 0.81 PRKDC (0.63) MAPTGAAHTTALDH1A1KMT2A
SCHEMBL3685663 0.81 ALDH1A1 (0.56) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL76547 0.79 GAA (0.73) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL29745032 0.79 GAA (0.73) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL20128406 0.79 PIK3CD (0.40) MAPTKDM4EGAAPTK2BMAPK1
Ammonia Solution, Strong SCHEMBL14746306 0.78 GAA (0.71) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL11262976 0.77 PIK3CD (0.68) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL15448633 0.77 ALDH1A1 (0.56) MAPTKDM4EGAAPTK2BMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221371-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-08-07 US disclosed
US-20100041698-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2010-02-18 US disclosed
EP-1917245-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS Abbott GmbH & Co. KG (DE) 2008-05-07 EP disclosed
WO-2007022946-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS ABBOTT GMBH & CO. KG (DE) 2007-03-01 WO 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-20140221371-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS HTR5A, HTR1A, HTR2C MAPT 73/4885KDM4E 3028/4885GAA 3123/4885
US-20100041698-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS BINDING PARTNERS FOR 5-HT5 RECEPTORS HTR5A, HTR1A, HTR2C MAPT 73/4885KDM4E 3028/4885GAA 3123/4885

“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.