SCHEMBL21607007

SCHEMBL21607007

Cc1nc2cc(C(C)O)cnc2s1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
GAA P10253 1/20 0.34
MALT1 Q9UDY8 1/20 0.32
OGA O60502 3/20 0.32
TDP1 Q9NUW8 1/20 0.30
UGT2B7 P16662 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 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
SCHEMBL21606993 0.77 MAPT (0.35) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL10052411 0.76 MAPT (0.33) SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL21606992 0.75 OGA (0.38) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL10076920 0.75 NPC1 (0.33) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL7921134 0.74 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL16711669 0.72 SMN1; SMN2 (0.41) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL29974039 0.72 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL16476934 0.72 SMN1; SMN2 (0.41) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL1055102 0.72 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AHSD17B10MAPT
SCHEMBL17541632 0.71 SMN1; SMN2 (0.54) SMN1; SMN2NPC1RAB9AHSD17B10MAPT

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 SMN1; SMN2 103/4885NPC1 1281/4885RAB9A 2809/4885

“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.