SCHEMBL22886454

SCHEMBL22886454

O=C(O)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1cccc2oc(=O)[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.43
▸ CAPN1 P07384 14/20 0.39
▸ GRM5 P41594 2/20 0.38

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
SCHEMBL22886453 0.91 EPHX2 (0.45) EPHX2CAPN1GRM5
SCHEMBL22886452 0.82 EPHX2 (0.42) EPHX2GRM5
SCHEMBL22886543 0.81 L3MBTL1 (0.46) CAPN1
SCHEMBL22885869 0.79 CAPN1 (0.40) CAPN1
SCHEMBL22886426 0.78 FTO (0.42) CAPN1
SCHEMBL22886593 0.78 CAPN1 (0.36) CAPN1
SCHEMBL20027860 0.73 CAPN1 (0.52) CAPN1
SCHEMBL22886508 0.73 CAPN1 (0.45) CAPN1
SCHEMBL22886730 0.73 L3MBTL1 (0.41) CAPN1
SCHEMBL22886544 0.72 L3MBTL1 (0.44) CAPN1

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-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPERTICS INC (US) 2021-01-14 — — US disclosed
CN-112204014-A Calpain modulators and therapeutic uses thereof 布莱德治疗公司 2021-01-08 — — CN 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-20210009564-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN9, CAPN1 EPHX2 4376/4885CAPN1 3/4885GRM5 4134/4885

“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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