SCHEMBL21607006

SCHEMBL21607006

Cc1cc(CC2CCNCC2)cc(C)n1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.52
HRH3 Q9Y5N1 5/20 0.46
HRH4 Q9H3N8 4/20 0.46
KCNH2 Q12809 1/20 0.41
SLC6A4 P31645 4/20 0.40
CACNA1H O95180 2/20 0.40
TLR9 Q9NR96 3/20 0.38
TLR8 Q9NR97 3/20 0.38
TLR7 Q9NYK1 3/20 0.38
CACNA1G O43497 1/20 0.38
GPR4 P46093 1/20 0.36

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
SCHEMBL20281500 0.89 HRH3 (0.49) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL21358938 0.89 HRH3 (0.49) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL21603172 0.89 HRH3 (0.49) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL3967185 0.81 GBA1 (0.55) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL12696626 0.80 GBA1 (0.50) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL21359121 0.80 EED (0.52) HRH3HRH4KCNH2
SCHEMBL20281478 0.80 EED (0.52) HRH3HRH4KCNH2
SCHEMBL20281932 0.79 HRH4 (0.43) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL20281523 0.78 HRH4 (0.42) GBA1HRH3HRH4KCNH2SLC6A4
SCHEMBL21603160 0.77 EED (0.44) GBA1HRH3HRH4SLC6A4TLR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210122763-A1 OGA INHIBITOR COMPOUNDS JANSSEN-CILAG S.A. (ES) 2021-04-29 US disclosed
WO-2019243530-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 (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-20210122763-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN GBA1 18/4885HRH3 3480/4885HRH4 4152/4885

“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.