SCHEMBL21604598

SCHEMBL21604598

Cc1nc2ncc(F)cc2s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.41
HSD17B10 Q99714 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
LTA4H P09960 1/20 0.39
GAA P10253 1/20 0.38
USP2 O75604 1/20 0.34
ALOX15 P16050 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
HTT P42858 2/20 0.33
LMNA P02545 1/20 0.33
GRM5 P41594 1/20 0.33
AGBL2 Q5U5Z8 1/20 0.32
ABL1 P00519 2/20 0.32

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
SCHEMBL7912720 0.80 SMN1; SMN2 (0.43) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL1883389 0.77 LTA4H (0.41) ALDH1A1MAPTLTA4HGRM5AXL
SCHEMBL14970107 0.77 HRH3 (0.43) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL19061756 0.77 SMN1; SMN2 (0.50) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL22333711 0.77 SMN1; SMN2 (0.41) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL19001707 0.77 SMN1; SMN2 (0.41) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL4619770 0.77 SMN1; SMN2 (0.44) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL24150119 0.77 PKM (0.41) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL14046128 0.74 SMN1; SMN2 (0.38) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1
SCHEMBL24603575 0.73 SMN1; SMN2 (0.37) SMN1; SMN2HSD17B10NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4190784-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2023-06-07 EP disclosed
WO-2021123291-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-06-24 WO disclosed
WO-2021110656-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-06-10 WO disclosed
WO-2021094312-A1 PYRROLIDINE AND BICYCLOHETEROARYL CONTAINING OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-05-20 WO disclosed
US-20210122763-A1 OGA INHIBITOR COMPOUNDS JANSSEN-CILAG S.A. (ES) 2021-04-29 US disclosed
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
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 (2 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 103/4885HSD17B10 2463/4885NPC1 1281/4885
US-20210115040-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN SMN1; SMN2 103/4885HSD17B10 2463/4885NPC1 1281/4885

“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.