SCHEMBL25987740

SCHEMBL25987740

CC#CS(=O)(=O)NC1CCCN(C(=O)Nc2ccc(OC(F)(F)F)cc2)C1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 16/20 0.64
▸ SCN9A Q15858 1/20 0.49
▸ POLB P06746 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ LIPE Q05469 1/20 0.46
▸ EPHX1 P07099 3/20 0.46
▸ ACHE P22303 1/20 0.44

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
SCHEMBL23389102 1.00 EPHX2 (0.64) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL23389199 0.90 EPHX2 (0.61) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL23389220 0.83 EPHX2 (0.64) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL28885269 0.83 EPHX2 (0.64) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL25987957 0.83 EPHX2 (0.64) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL23419215 0.83 EPHX2 (0.63) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL23418851 0.83 EPHX2 (0.63) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL25987958 0.81 EPHX2 (0.62) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL23389248 0.81 EPHX2 (0.61) EPHX2SCN9APOLBCYP2C9CYP2C19
SCHEMBL23389093 0.80 EPHX2 (0.61) EPHX2SCN9APOLBCYP2C9CYP2C19

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-20230202974-A1 CASPASE 6 INHIBITORS AND USES THEREOF UNIV CALIFORNIA (US) 2023-06-29 — — 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-20230202974-A1 CASPASE 6 INHIBITORS AND USES THEREOF CASP6, CASP1, CASP10 EPHX2 3551/4885SCN9A 3345/4885POLB 4066/4885

“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.

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