SCHEMBL25754927

SCHEMBL25754927

O=C(O)c1cnc(-c2c(F)cccc2F)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.60
TTR P02766 1/20 0.46
DHODH Q02127 6/20 0.43
PTGES O14684 2/20 0.40
ALB P02768 1/20 0.37
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
MAPK14 Q16539 1/20 0.35
ADORA2B P29275 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
HCAR3 P49019 1/20 0.34
PARP1 P09874 1/20 0.34

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
SCHEMBL25754929 0.76 PIN1 (0.55) PIN1DHODHPARP1
SCHEMBL3057838 0.75 PIN1 (1.00) PIN1
SCHEMBL17868429 0.75 PIN1 (0.72) PIN1DHODHMMP1MMP2MMP9
SCHEMBL14334074 0.71 HRH1 (0.39) TTRPTGESMAPK14ADORA2B
SCHEMBL14334396 0.71 PTGES (0.39) TTRDHODHPTGESMAPK14ADORA2B
SCHEMBL22687517 0.70
SCHEMBL1896303 0.70 PIN1 (0.65) PIN1EGLN1
SCHEMBL25170451 0.70 SCN2A (0.63) PIN1PARP1
SCHEMBL30371688 0.70 SCN2A (0.63) PIN1PARP1
SCHEMBL23846978 0.70 PIN1 (0.69) PIN1EGLN1PARP1

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 3482/4885TTR 104/4885DHODH 2900/4885

“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.