SCHEMBL21052298

SCHEMBL21052298

Cn1nc([Sn](C)(C)C)c2ncccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.36
NAMPT P43490 3/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2A P29274 1/20 0.35
HSP90AA1 P07900 3/20 0.34
NPC1 O15118 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MMP2 P08253 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
MMP9 P14780 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33

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
SCHEMBL30692827 1.00 SSTR4 (0.36) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL14738488 0.77 GRM4 (0.35) SSTR4NAMPTGRM4
SCHEMBL1577651 0.76 GRM4 (0.43) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL17045432 0.76 HSP90AA1 (0.43) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL31052526 0.76 HSP90AA1 (0.43) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL31298611 0.74 HSP90AA1 (0.38) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL14074980 0.74 SSTR4 (0.38) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL14074978 0.74 SSTR4 (0.38) SSTR4NAMPTADORA3ADORA2AHSP90AA1
SCHEMBL30883806 0.72 KDM4E (0.41) SSTR4KDM4ECYP3A4MAPTTSHR
SCHEMBL15332274 0.72 KDM4E (0.41) SSTR4KDM4ECYP3A4MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230026909-A1 1,2,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE 6 INHIBITORS ORYZON GENOMICS, S.A. (ES) 2023-01-26 US disclosed
US-20200339569-A1 1,2,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE 6 INHIBITORS ORYZON GENOMICS, S.A. (ES) 2020-10-29 US disclosed
EP-3720851-A1 1,2,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE 6 INHIBITORS Oryzon Genomics, S.A. (ES) 2020-10-14 EP disclosed
CN-111406054-A 1, 2, 4-oxadiazole derivatives as inhibitors of histone deacetylase 6 奥莱松基因组股份有限公司 2020-07-10 CN disclosed
WO-2019110663-A1 1,2,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE 6 INHIBITORS ORYZON GENOMICS, S.A. (ES) 2019-06-13 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-20200339569-A1 1,2,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE 6 INHIBITORS HDAC6, HDAC1, HDAC3 SSTR4 4214/4885NAMPT 358/4885ADORA3 4085/4885
US-20230026909-A1 1,2,4-OXADIAZOLE DERIVATIVES AS HISTONE DEACETYLASE 6 INHIBITORS HDAC6, HDAC1, HDAC3 SSTR4 4214/4885NAMPT 358/4885ADORA3 4085/4885

“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.