SCHEMBL5156396

SCHEMBL5156396

Cc1cccc(-c2ccc(C34CCCN(CC3)C4)cn2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.43
ALOX5AP P20292 1/20 0.42
IDO1 P14902 1/20 0.35
METAP2 P50579 1/20 0.35
GRIN2B Q13224 2/20 0.35
HTR3A P46098 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35

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
Bromide SCHEMBL4466442 0.99 KDM1A (0.42) KDM1AALOX5APIDO1METAP2GRIN2B
SCHEMBL5221907 0.89 GRM5 (0.34) KDM1AALOX5APHCRTR1HCRTR2
Bromide SCHEMBL4469519 0.88 ALOX5AP (0.33) KDM1AALOX5APHCRTR1HCRTR2
SCHEMBL4466231 0.86 HPGDS (0.41) IDO1
SCHEMBL4463296 0.85 HSD11B1 (0.40) HCRTR1HCRTR2
Bromide SCHEMBL4480660 0.85 HPGDS (0.41) IDO1HCRTR1HCRTR2
SCHEMBL2678305 0.85 KDM1A (0.47) KDM1AHTR3AMEN1KMT2A
Bromide SCHEMBL4461513 0.84 CHRNA7 (0.39) KDM1AALOX5APKMT2A
Bromide SCHEMBL4471147 0.84 HSD11B1 (0.39) HCRTR1HCRTR2
SCHEMBL2678219 0.83 HPGDS (0.43) IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465893-B1 DERIVATIVES OF 5-(PYRIDIN-3-YL)-1-AZABICYCLO (3.2.1) OCTANE, THE PREPARATION THEREOF AND THE APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2007-02-28 EP claimed
US-7223750-B2 Derivatives of 5-(pyridin-3-yl)-1-azabicyclo[3.2.1]octane, the preparation thereof and the application of same in therapeutics SANOFI-AVENTIS (FR) 2007-05-29 US disclosed
US-20050020568-A1 Derivatives of 5-(pyridin-3-yl)-1-azabicyclo[3.2.1] octane, the preparation thereof and the application of same in therapeutics SANOFI (FR) 2005-01-27 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 (1 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-20050020568-A1 Derivatives of 5-(pyridin-3-yl)-1-azabicyclo[3.2.1] octane, the preparation thereof and the application of same in therapeutics PAICS, NAT1, TPMT KDM1A 866/4885ALOX5AP 878/4885IDO1 21/4885

“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.