SCHEMBL2163763

SCHEMBL2163763

CN(C(=O)OC(C)(C)C)c1ccc(-c2cc3ccccc3cn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.57
RAB9A P51151 6/20 0.50
NPC1 O15118 5/20 0.50
BRD4 O60885 2/20 0.41
CREBBP Q92793 1/20 0.40
CASP3 P42574 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KAT6A Q92794 1/20 0.36
KAT5 Q92993 1/20 0.36
KAT8 Q9H7Z6 1/20 0.36
PDE10A Q9Y233 1/20 0.36
LIPE Q05469 2/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TTK P33981 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
SCHEMBL483789 0.82 NPC1 (0.54) RAB9ANPC1CASP3SENP7PDE10A
SCHEMBL483842 0.81 PAX8 (0.60) PAX8RAB9ANPC1BRD4CREBBP
SCHEMBL3633134 0.79 PAX8 (0.43) PAX8BRD4KDM4ETTK
SCHEMBL31453143 0.77 PAX8 (0.51) PAX8RAB9ANPC1BRD4CREBBP
SCHEMBL1691044 0.77 PAX8 (0.60) PAX8RAB9ANPC1BRD4CREBBP
SCHEMBL3638071 0.76 PAX8 (0.53) PAX8RAB9ANPC1BRD4KMT2A
SCHEMBL2163923 0.75 NPC1 (0.63) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL8018111 0.75 PAX8 (0.55) PAX8RAB9ANPC1BRD4CREBBP
SCHEMBL12324092 0.75 PAX8 (0.53) PAX8RAB9ANPC1BRD4CREBBP
SCHEMBL2163741 0.74 PAX8 (0.58) PAX8RAB9ANPC1BRD4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110182812-A1 Imaging Agents for Detecting Neurological Disorders SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-07-28 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-20110182812-A1 Imaging Agents for Detecting Neurological Disorders MAPT, APP, PSEN1 PAX8 4170/4885RAB9A 1434/4885NPC1 143/4885

“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.