SCHEMBL25877659

SCHEMBL25877659

NC(=O)C(Cl)(Cl)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.31
PRSS1 P07477 2/20 0.31
PRSS2 P07478 2/20 0.31
PRSS3 P35030 2/20 0.31
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL31272081 0.81 F2 (0.31) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL10638964 0.76
SCHEMBL751015 0.76
SCHEMBL25877715 0.75 ALDH1A1 (0.30) ALDH1A1TP53TSHR
SCHEMBL11724639 0.73 ALDH1A1 (0.33) ALDH1A1TP53TSHR
SCHEMBL3503299 0.73 ALDH1A1 (0.33) ALDH1A1TP53TSHR
SCHEMBL10454353 0.71 ALDH1A1 (0.47) ALDH1A1TP53TSHR
Trifluoroacetamide SCHEMBL20915034 0.71 ALDH1A1 (0.39) ALDH1A1TP53TSHR
SCHEMBL28203079 0.71 ALDH1A1 (0.32) ALDH1A1TP53TSHR
SCHEMBL15993915 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234921-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-07-27 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-20230234921-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF SERPINB1, CTSV, CTSE F2 1445/4885PRSS1 20/4885PRSS2 22/4885

“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.