SCHEMBL21020091

SCHEMBL21020091

CS(=O)(=O)c1nc(N)cc(-c2cccs2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.67
ALDH1A1 P00352 7/20 0.67
KMT2A Q03164 6/20 0.67
HSD17B10 Q99714 5/20 0.67
HPGD P15428 5/20 0.67
SDHB P21912 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
MAPK1 P28482 4/20 0.67
NPC1 O15118 3/20 0.67
NPSR1 Q6W5P4 2/20 0.67
HTT P42858 2/20 0.67
RAB9A P51151 2/20 0.67
S1PR4 O95977 1/20 0.67
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
S1PR1 P21453 1/20 0.67
MEN1 O00255 5/20 0.51
MAPT P10636 5/20 0.51
CASP1 P29466 2/20 0.51
CASP7 P55210 2/20 0.51

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
SCHEMBL19805771 0.91 SDHB (0.74) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL19805805 0.85 KMT2A (0.67) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL29976580 0.85 KMT2A (0.67) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL23880497 0.84 SDHB (0.65) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL29976822 0.80 SDHB (0.61) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL21019805 0.80 SDHB (1.00) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL19805815 0.80 SDHB (0.61) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL23162731 0.78 ALDH1A1 (0.51) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL29976226 0.77 SDHB (0.57) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL19805663 0.77 SDHB (0.57) KDM4EALDH1A1KMT2AHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 US disclosed
US-20210309647-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-10-07 US disclosed
US-11034680-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-06-15 US disclosed
US-20190152960-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2019-05-23 US 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 (4 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-20190152960-A1 Apoptosis Inhibitors BAX, SDHA, SDHB KDM4E 1117/4885ALDH1A1 550/4885KMT2A 3060/4885
US-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB KDM4E 1117/4885ALDH1A1 550/4885KMT2A 3060/4885
US-11034680-B2 Apoptosis inhibitors BAX, SDHA, SDHB KDM4E 1117/4885ALDH1A1 550/4885KMT2A 3060/4885
US-20210309647-A1 Apoptosis Inhibitors BAX, SDHA, SDHB KDM4E 1117/4885ALDH1A1 550/4885KMT2A 3060/4885

“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.