SCHEMBL16260486

SCHEMBL16260486

CC(C)(C)Cc1ccc(N2CCOCC2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
MAPT P10636 9/20 0.44
ALDH1A1 P00352 6/20 0.44
MEN1 O00255 3/20 0.44
HTT P42858 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HSD17B10 Q99714 2/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 2/20 0.44
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
CYP1A2 P05177 1/20 0.44
PCSK9 Q8NBP7 1/20 0.43
MAPK1 P28482 2/20 0.42
TP53 P04637 2/20 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
SCHEMBL807518 0.83 POLB (0.51) POLBMAPTALDH1A1MEN1HTT
SCHEMBL23916698 0.81 POLB (0.45) POLBMAPTALDH1A1MEN1HTT
SCHEMBL18929856 0.80 POLB (0.49) POLBMAPTALDH1A1MEN1HTT
SCHEMBL3650490 0.80 POLB (0.51) POLBMAPTALDH1A1MEN1HTT
SCHEMBL8194202 0.80 POLB (0.51) POLBMAPTALDH1A1MEN1HTT
SCHEMBL20306363 0.77 AOC3 (0.58) MAPTMEN1KMT2APRMT5
SCHEMBL9969466 0.77 MAPT (0.50) MAPTALDH1A1MEN1HTTKMT2A
SCHEMBL18115210 0.77 POLB (0.49) POLBMAPTALDH1A1MEN1HTT
SCHEMBL26351832 0.77 HRH3 (0.49) MAPTALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL14008911 0.76 POLB (0.55) POLBMAPTALDH1A1MEN1HTT

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-20140349994-A1 Novel 2-Amino-4,5,6,8-Tetrahydropyrazolo[3,4-b]Thiazolo [4,5-d]Azepine Derivatives and Their Use as Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA S.A. (CH) 2014-11-27 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-20140349994-A1 Novel 2-Amino-4,5,6,8-Tetrahydropyrazolo[3,4-b]Thiazolo [4,5-d]Azepine Derivatives and Their Use as Allosteric Modulators of Metabotropic Glutamate Receptors GRM4, GRM1, GRM5 POLB 4844/4885MAPT 1719/4885ALDH1A1 2935/4885

“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.