SCHEMBL21604616

SCHEMBL21604616

C=Cc1cnc2oc(C)nc2c1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.32
PARP1 P09874 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
ELANE P08246 1/20 0.30
GRM5 P41594 1/20 0.30

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
SCHEMBL21604519 0.83 KDM4E (0.34) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL7914428 0.77 CYP1A2 (0.41) GAAKDM4ENPC1ALDH1A1RAB9A
SCHEMBL15691375 0.73 ELANE (0.33) GAAELANE
SCHEMBL16990351 0.73 IDO1 (0.41) GAAKDM4ENPC1ALDH1A1MAPT
SCHEMBL21604527 0.72 HRH3 (0.46) GAAPARP1HDAC8HRH3GRM5
SCHEMBL3684471 0.70 GAA (0.51) GAAKDM4ENPC1ALDH1A1LMNA
SCHEMBL18136190 0.70 SMN1; SMN2 (0.40) KDM4EALDH1A1MAPTPKMRAB9A
SCHEMBL19267574 0.68 ELANE (0.39) GAAKDM4ENPC1ALDH1A1MAPT
SCHEMBL19465805 0.67 OGA (0.32) ALDH1A1ELANE
SCHEMBL19021282 0.66 ALDH1A1 (0.41) PARP1KDM4ENPC1ALDH1A1MAPT

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-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

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-20210115040-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN GAA 15/4885PARP1 345/4885HDAC8 1371/4885

“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.