SCHEMBL25754942

SCHEMBL25754942

O=C(O)c1cnc(-c2ccsc2)[nH]1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.63
BCHE P06276 1/20 0.41
CHEK2 O96017 2/20 0.41
GPR35 Q9HC97 1/20 0.40
BRD4 O60885 1/20 0.40
DHODH Q02127 2/20 0.40
ACMSD Q8TDX5 1/20 0.40
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
DAO P14920 1/20 0.39
GSK3B P49841 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
CYP2A6 P11509 3/20 0.37
CYP2E1 P05181 2/20 0.37

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
SCHEMBL3057838 0.78 PIN1 (1.00) PIN1
SCHEMBL17868506 0.73 PIN1 (0.72) PIN1
SCHEMBL17868429 0.73 PIN1 (0.72) PIN1CHEK2DHODH
SCHEMBL14953213 0.73 PIN1 (0.72) PIN1CHEK2
SCHEMBL9940321 0.73 PIN1 (0.67) PIN1
SCHEMBL7699701 0.73 PIN1 (0.72) PIN1DHODH
SCHEMBL10956456 0.72 SCN2A (0.68) BCHECYP2A6CYP2E1CYP2B6
Hydrochloric Acid SCHEMBL27325075 0.72 PIN1 (0.70) PIN1
SCHEMBL25754931 0.71 PIN1 (0.58) PIN1DHODHDAO
SCHEMBL23846993 0.70 PIN1 (0.66) PIN1CHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2023-06-08 US disclosed
US-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2023-06-08 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-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF TRAP1, PINK1, TP53BP1 PIN1 3482/4885BCHE 3769/4885CHEK2 1990/4885

“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.