SCHEMBL21885546

SCHEMBL21885546

Cc1ccc(S(=O)(=O)NC(Cc2ccccn2)C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.58
MMP9 P14780 7/20 0.56
MMP2 P08253 7/20 0.54
ADAMTS4 O75173 2/20 0.54
MMP3 P08254 1/20 0.54
MMP13 P45452 1/20 0.54
HTT P42858 1/20 0.54
ATM Q13315 1/20 0.54
ALDH1A1 P00352 2/20 0.52
MAPT P10636 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.51
PTGS2 P35354 1/20 0.50
ADAMTS5 Q9UNA0 1/20 0.49

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
SCHEMBL29831835 1.00 TDP1 (0.58) TDP1MMP9MMP2ADAMTS4MMP3
SCHEMBL16058523 1.00 TDP1 (0.58) TDP1MMP9MMP2ADAMTS4MMP3
SCHEMBL697476 0.82 MMP2 (0.79) TDP1MMP9MMP2ADAMTS4MMP3
SCHEMBL1203540 0.82 MMP2 (0.79) TDP1MMP9MMP2ADAMTS4MMP3
SCHEMBL697477 0.82 MMP2 (0.79) TDP1MMP9MMP2ADAMTS4MMP3
Hydrochloric Acid SCHEMBL11133046 0.81 MMP2 (0.77) TDP1MMP9MMP2ADAMTS4MMP3
Hydrochloric Acid SCHEMBL3839410 0.81 MMP2 (0.77) TDP1MMP9MMP2ADAMTS4MMP3
SCHEMBL7879499 0.80 TDP1 (0.55) TDP1MMP9MMP2ADAMTS4MMP3
Chloromethane SCHEMBL7649372 0.80 MMP2 (0.75) TDP1MMP9MMP2ADAMTS4MMP3
Hydrochloric Acid SCHEMBL28872216 0.80 MMP2 (0.75) TDP1MMP9MMP2ADAMTS4MMP3

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
CN-109369635-B Compound or pharmaceutically acceptable salt thereof, application thereof and pharmaceutical composition 赛克里翁治疗有限公司 2023-06-30 CN disclosed
CN-109384778-B Use of a compound or a pharmaceutically acceptable salt thereof for the manufacture of a medicament for the treatment of a disease, health condition or disorder 赛克里翁治疗有限公司 2022-12-13 CN disclosed
CN-110016020-B Compound or pharmaceutically acceptable salt thereof, application and pharmaceutical composition thereof 赛克里翁治疗有限公司 2022-07-26 CN disclosed
CN-108912111-B Compounds and pharmaceutical compositions 赛克里翁治疗有限公司 2021-09-14 CN disclosed
US-10639308-B2 sGC stimulators CYCLERION THERAPEUTICS, INC. (US) 2020-05-05 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 (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-10639308-B2 sGC stimulators PTGIS, CGAS, GUCY1A1 TDP1 711/4885MMP9 4402/4885MMP2 3522/4885

“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.