SCHEMBL10001929

SCHEMBL10001929

CN1CCOCCN(C)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MGLL Q99685 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KEAP1 Q14145 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
CYP1A2 P05177 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2A13 Q16696 1/20 0.35
HPGD P15428 1/20 0.35
PRKCB P05771 2/20 0.34
PRKCA P17252 2/20 0.34
GSK3B P49841 2/20 0.34

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
SCHEMBL9906194 1.00 CA12 (0.43) CA12CA7CA14MGLLNPSR1
Fluoride SCHEMBL28310400 0.96
SCHEMBL1221354 0.96
SCHEMBL20614479 0.96 CA12 (0.45) CA12CA7CA14MGLLNPSR1
SCHEMBL10001930 0.96 CA12 (0.45) CA12CA7CA14MGLLNPSR1
SCHEMBL8136165 0.96
SCHEMBL2123718 0.96 CA12 (0.45) CA12CA7CA14MGLLNPSR1
SCHEMBL4622 0.96
SCHEMBL24525605 0.93 SMN1; SMN2 (0.43) CA12CA7CA14MGLLSMN1; SMN2
SCHEMBL254989 0.93 SMN1; SMN2 (0.43) CA12CA7CA14MGLLSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110404-B2 Luminescent lanthanide binding chelates BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-02-07 US disclosed
US-8110404-B2 Luminescent lanthanide binding chelates BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-02-07 US disclosed
US-20080299675-A1 Luminescent Lanthanide Binding Chelates BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2008-12-04 US disclosed
US-20080299675-A1 Luminescent Lanthanide Binding Chelates BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2008-12-04 US disclosed
WO-2007055700-A1 LUMINESCENT LANTHANIDE BINDING CHELATES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-05-18 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 (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-20080299675-A1 Luminescent Lanthanide Binding Chelates HLCS, LYAR, SLC6A13 CA12 450/4885CA7 801/4885CA14 679/4885

“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.