SCHEMBL21608201

SCHEMBL21608201

COc1cc(C[C@H]2CCN(C(C)c3cccc(OC)n3)C2)cc(C)n1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
OGA O60502 1/20 0.34
KCNH2 Q12809 1/20 0.32
GHSR Q92847 1/20 0.32
HTR1A P08908 2/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
HTT P42858 2/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
XBP1 P17861 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
EED O75530 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
DGKZ Q13574 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL21608202 1.00 KDM4E (0.34) KDM4EOGAKCNH2GHSRHTR1A
SCHEMBL21607943 0.90 KCNH2 (0.39) KDM4EOGAKCNH2GHSRHTT
SCHEMBL21607953 0.90 KCNH2 (0.39) KDM4EOGAKCNH2GHSRHTT
SCHEMBL21607991 0.89 MGLL (0.33) KDM4EOGATSHR
SCHEMBL21607983 0.89 MGLL (0.33) KDM4EOGATSHR
SCHEMBL21608061 0.86 MGLL (0.36)
SCHEMBL21608064 0.86 MGLL (0.36)
SCHEMBL21608004 0.86 LOX (0.37) KDM4EOGAHTR1AHTR1DHTR1B
SCHEMBL21608003 0.86 LOX (0.37) KDM4EOGAHTR1AHTR1DHTR1B
SCHEMBL21608548 0.83 KDM1A (0.35) KDM4EOGAKCNH2GHSRMAPT

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-20210300900-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 US disclosed
WO-2019243531-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-20210300900-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN KDM4E 1495/4885OGA 1/4885KCNH2 4103/4885

“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.