SCHEMBL21607970

SCHEMBL21607970

CNC(=O)c1cncc(C(C)=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 3/20 0.48
XDH P47989 1/20 0.46
MKNK1 Q9BUB5 3/20 0.45
MKNK2 Q9HBH9 3/20 0.45
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PTGS2 P35354 2/20 0.42
PLK1 P53350 1/20 0.41
PTGS1 P23219 1/20 0.41
ICAM1 P05362 1/20 0.41
SELE P16581 1/20 0.41
HDAC2 Q92769 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40

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
SCHEMBL5909485 0.92 RAF1 (0.53) RAF1MKNK1MKNK2HDAC8HDAC6
SCHEMBL3500223 0.85 MKNK1 (0.55) XDHMKNK1MKNK2KDM4EALDH1A1
SCHEMBL4267075 0.82 MKNK1 (0.49) RAF1MKNK1MKNK2HDAC8HDAC6
SCHEMBL16350551 0.81 HDAC8 (0.52) HDAC8HDAC6ALDH1A1PLK1HDAC2
SCHEMBL19988556 0.81 HDAC8 (0.52) HDAC8HDAC6ALDH1A1PLK1HDAC2
SCHEMBL3168799 0.80 KDM4E (0.59) RAF1MKNK1MKNK2KDM4EALDH1A1
SCHEMBL10274534 0.80 HCAR2 (0.62) RAF1MKNK1MKNK2KDM4EALDH1A1
SCHEMBL19135598 0.79 RAF1 (0.44) RAF1KDM4EALDH1A1NPC1RAB9A
SCHEMBL3829749 0.79 RAF1 (0.44) RAF1MKNK1MKNK2HDAC8HDAC6
SCHEMBL23252551 0.78 RAF1 (0.47) RAF1MKNK1MKNK2HDAC8HDAC6

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 RAF1 4682/4885XDH 1807/4885MKNK1 1213/4885

“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.