SCHEMBL24435489

SCHEMBL24435489

CC(=O)N1CCC(C#CS)CC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.41
EPHX1 P07099 3/20 0.41
QDPR P09417 1/20 0.40
CYP1A2 P05177 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BRD4 O60885 1/20 0.33

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
SCHEMBL24935704 0.82 EPHX2 (0.42) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL6107767 0.79 EPHX2 (0.43) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL19498073 0.77 EPHX2 (0.41) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL23509414 0.77 PIK3CD (0.39) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL57711 0.77 CYP1A2 (0.44) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL3764738 0.75 EPHX2 (0.43) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL27270646 0.74 EPHX2 (0.37) EPHX2EPHX1CYP1A2TDP1
SCHEMBL21472126 0.72 CYP1A2 (0.48) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL20255973 0.72 CYP1A2 (0.48) EPHX2EPHX1QDPRCYP1A2TDP1
SCHEMBL329321 0.71 CYP1A2 (0.52) EPHX2EPHX1QDPRCYP1A2TDP1

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G EPHX2 3730/4885EPHX1 3446/4885QDPR 3903/4885

“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.