SCHEMBL20488686

SCHEMBL20488686

CCn1c(S(C)(=O)=O)nc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MLKL Q8NB16 1/20 0.66
TSHR P16473 1/20 0.61
MAPK1 P28482 2/20 0.58
HTT P42858 4/20 0.51
USP2 O75604 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NCOA3 Q9Y6Q9 3/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
RECQL P46063 1/20 0.50
ALDH1A1 P00352 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
NCOA1 Q15788 2/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL21602569 0.90 MLKL (0.68) MLKLTSHRMAPK1HTTUSP2
SCHEMBL20489190 0.88 TSHR (0.61) MLKLTSHRMAPK1HTTUSP2
SCHEMBL20489178 0.85 MLKL (0.63) MLKLTSHRMAPK1HTTUSP2
SCHEMBL21602480 0.84 MLKL (0.77) MLKLTSHRMAPK1HTTUSP2
SCHEMBL21602541 0.84 TSHR (0.57) MLKLTSHRMAPK1HTTUSP2
SCHEMBL21602576 0.83 MLKL (0.60) MLKLTSHRMAPK1USP2L3MBTL1
SCHEMBL21602606 0.82 MLKL (0.58) MLKLMAPK1L3MBTL1CYP2C19ALDH1A1
SCHEMBL21602440 0.82 MLKL (0.59) MLKLTSHRMAPK1HTTUSP2
SCHEMBL20488494 0.82 MLKL (0.49) MLKLTSHRMAPK1HTTL3MBTL1
SCHEMBL21602443 0.82 MLKL (0.49) MLKLTSHRMAPK1HTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3612223-B1 TREATING MALE SENESCENCE NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2024-07-31 EP claimed
CN-110769853-B Treatment of male aging 北京生命科学研究所 2022-06-03 CN claimed
US-11090307-B2 Treating male senescence NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-08-17 US claimed
CN-110769853-A Treatment of male aging 北京生命科学研究所 2020-02-07 CN claimed
EP-3612223-B1 TREATING MALE SENESCENCE NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2024-07-31 EP disclosed
CN-117320754-A Prostatitis treatment 北京生命科学研究所 2023-12-29 CN disclosed
US-11666577-B2 MLKL inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-06-06 US disclosed
US-11666577-B2 MLKL inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-06-06 US disclosed
US-11666577-B2 MLKL inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-06-06 US disclosed
CN-110573509-B MLKL inhibitors 北京生命科学研究所 2023-05-26 CN disclosed
US-20220288077-A1 PROSTATITIS TREATMENT NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES (CN) 2022-09-15 US disclosed
EP-4017535-A1 PROSTATITIS TREATMENT National Institute Of Biological Sciences, Beijing (CN) 2022-06-29 EP disclosed
CN-110769853-B Treatment of male aging 北京生命科学研究所 2022-06-03 CN disclosed
US-11090307-B2 Treating male senescence NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-08-17 US disclosed
US-11090307-B2 Treating male senescence NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-08-17 US disclosed
US-20200046714-A1 Treating Male Senescence NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2020-02-13 US disclosed
CN-110769853-A Treatment of male aging 北京生命科学研究所 2020-02-07 CN disclosed
WO-2019242576-A1 TREATING DEMYELINATING DISEASE NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2019-12-26 WO disclosed
CN-110573509-A MLKL inhibitors 北京生命科学研究所 2019-12-13 CN disclosed
WO-2018157800-A1 MLKL INHIBITORS NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2018-09-07 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 (3 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-11090307-B2 Treating male senescence RIPK3, RIPK1, MLKL MLKL 3/4885TSHR 4353/4885MAPK1 248/4885
US-20200046714-A1 Treating Male Senescence RIPK3, RIPK1, MLKL MLKL 3/4885TSHR 4353/4885MAPK1 248/4885
US-11666577-B2 MLKL inhibitors MLKL, CMKLR1, PCSK9 MLKL 1/4885TSHR 4699/4885MAPK1 756/4885

“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.