SCHEMBL8260640

SCHEMBL8260640

CC(C)(N)C(N)c1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.40
IDO1 P14902 2/20 0.39
TDO2 P48775 2/20 0.39
HSD11B1 P28845 8/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.35
ACHE P22303 1/20 0.34
MAPKAPK2 P49137 1/20 0.33

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
Hydrochloric Acid SCHEMBL3024235 0.98 IDO1 (0.42) PDE2AIDO1TDO2HSD11B1CES2
SCHEMBL17439882 0.82 PDE2A (0.41) PDE2AIDO1TDO2HSD11B1CES2
Hydrochloric Acid SCHEMBL28666635 0.80 PDE2A (0.41) PDE2AIDO1TDO2HSD11B1CES2
SCHEMBL20238027 0.78 IDO1 (0.41) PDE2AIDO1TDO2HSD11B1CES2
SCHEMBL26931399 0.78 IDO1 (0.41) PDE2AIDO1TDO2HSD11B1CES2
SCHEMBL20238028 0.78 IDO1 (0.41) PDE2AIDO1TDO2HSD11B1CES2
SCHEMBL29669053 0.78 IDO1 (0.41) PDE2AIDO1TDO2HSD11B1CES2
SCHEMBL23139487 0.78 PDE2A (0.48) PDE2AIDO1TDO2CES2CES1
SCHEMBL29394861 0.78 PDE2A (0.48) PDE2AIDO1TDO2CES2CES1
SCHEMBL29621462 0.78 PDE2A (0.48) PDE2AIDO1TDO2CES2CES1

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
US-20100216837-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2010-08-26 US disclosed
US-20100216837-A1 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2010-08-26 US disclosed
WO-2006067414-A2 GLYCINE TRANSPORT INHIBITORS GLAXO GROUP LIMITED (GB) 2006-06-29 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-20100216837-A1 GLYCINE TRANSPORT INHIBITORS SLC18A2, SLC6A5, SLC1A2 PDE2A 1525/4885IDO1 516/4885TDO2 534/4885

“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.