SCHEMBL46323

SCHEMBL46323

Cc1cnc2c(c1)OCC(=O)N2C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 12/20 0.46
GABRG2 P18507 11/20 0.46
GABRB3 P28472 11/20 0.46
CYP11B2 P19099 2/20 0.40
CYP11B1 P15538 1/20 0.40
TERT O14746 1/20 0.39
PDE3B Q13370 3/20 0.36
PDE3A Q14432 3/20 0.36
GABRA1 P14867 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 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
SCHEMBL16972862 0.83 GABRG2 (0.43) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL13178859 0.83 GABRG2 (0.43) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL7318495 0.83 GABRG2 (0.43) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL7323714 0.80 GABRA5 (0.41) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL21603212 0.80 GABRA5 (0.46) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL13140226 0.80 TERT (0.36) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL16601586 0.80 TSHR (0.38) GABRA5GABRG2GABRB3TERTTSHR
SCHEMBL21603242 0.79 GABRA5 (0.45) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL18227101 0.78 TERT (0.44) GABRA5GABRG2GABRB3CYP11B2CYP11B1
SCHEMBL10203483 0.78 TSHR (0.41) GABRA5GABRG2GABRB3TERTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210300943-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 US disclosed
US-20210277015-A1 OGA INHIBITOR COMPOUNDS JANSSEN-CILAG S.A. (ES) 2021-09-09 US disclosed
WO-2019243527-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 WO disclosed
WO-2019243526-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 WO disclosed
WO-2011151436-A2 NOVEL COMPOUNDS, METHOD FOR USE THEM AND PHARMACEUTICAL COMPOSITION CONTAINING THEM EUROSCREEN S.A. (BE) 2011-12-08 WO disclosed
WO-2011151434-A1 NOVEL COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-12-08 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 (2 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-20210300943-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN GABRA5 3015/4885GABRG2 2419/4885GABRB3 3176/4885
US-20210277015-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN GABRA5 3015/4885GABRG2 2419/4885GABRB3 3176/4885

“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.