SCHEMBL22886086

SCHEMBL22886086

CC(C)n1c(=O)[nH]c2c(-c3nn(C)cc3C(=O)NC(Cc3ccccc3)C(=O)C(N)=O)cccc21

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 19/20 0.44
▸ DCAF1 Q9Y4B6 1/20 0.41

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
SCHEMBL22886085 0.84 CAPN1 (0.44) CAPN1DCAF1
SCHEMBL22886554 0.82 CAPN1 (0.47) CAPN1DCAF1
SCHEMBL20027501 0.82 CAPN1 (0.52) CAPN1DCAF1
SCHEMBL21854058 0.82 CAPN1 (0.52) CAPN1DCAF1
SCHEMBL22886659 0.80 CAPN1 (0.46) CAPN1DCAF1
SCHEMBL22885977 0.80 CAPN1 (0.50) CAPN1DCAF1
SCHEMBL22886479 0.80 CAPN1 (0.50) CAPN1DCAF1
SCHEMBL21854069 0.80 CAPN1 (0.52) CAPN1DCAF1
SCHEMBL20028477 0.79 CAPN1 (0.52) CAPN1DCAF1
SCHEMBL22886669 0.79 CAPN1 (0.47) CAPN1DCAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112703188-A Method for treating liver fibrosis using calpain inhibitor 布莱德治疗公司 2021-04-23 — — CN disclosed
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 CAPN1 3/4885DCAF1 2355/4885

“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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