SCHEMBL21603155

SCHEMBL21603155

Cc1cc(OC[C@H]2CCNC2)cc(C)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.58
SLC6A4 P31645 6/20 0.58
SLC6A3 Q01959 3/20 0.58
KDM1A O60341 5/20 0.47
KCNH2 Q12809 4/20 0.47
RCOR1 Q9UKL0 1/20 0.47
HTR3A P46098 2/20 0.47
PRKCZ Q05513 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
NOS3 P29474 1/20 0.43
NOS1 P29475 1/20 0.43
NOS2 P35228 1/20 0.43
GPR4 P46093 1/20 0.42
MAP2K1 Q02750 2/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
CHRNB3 Q05901 1/20 0.40
CHRNA6 Q15825 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.39

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
SCHEMBL21604566 1.00 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL20281548 1.00 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL21604516 0.91 MAP2K1 (0.51) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL20281495 0.91 MAP2K1 (0.51) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL21604534 0.91 MAP2K1 (0.51) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL21607279 0.90 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL21603166 0.89 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL21604593 0.81 MAP2K1 (0.46) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL21604589 0.81 MAP2K1 (0.46) SLC6A2SLC6A4SLC6A3KDM1AKCNH2
SCHEMBL23481099 0.79 PDE4A (0.38) SLC6A2SLC6A4SLC6A3KDM1AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210277015-A1 OGA INHIBITOR COMPOUNDS JANSSEN-CILAG S.A. (ES) 2021-09-09 US disclosed
US-20210115040-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-04-22 US disclosed
WO-2019243528-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 WO disclosed
WO-2019243527-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 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-20210277015-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN SLC6A2 3601/4885SLC6A4 3676/4885SLC6A3 3377/4885
US-20210115040-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN SLC6A2 3601/4885SLC6A4 3676/4885SLC6A3 3377/4885

“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.