SCHEMBL22896879

SCHEMBL22896879

NC(=O)C(=O)C(Cc1ccccn1)NC(=O)c1cn[nH]c1-c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DCAF1 Q9Y4B6 6/20 0.44
▸ CAPN1 P07384 12/20 0.44
▸ CTSS P25774 2/20 0.41
▸ CTSK P43235 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
SCHEMBL22897074 0.90 CAPN1 (0.55) DCAF1CAPN1CTSS
SCHEMBL22896922 0.88 CAPN1 (0.49) DCAF1CAPN1CTSS
SCHEMBL22896815 0.86 DCAF1 (0.44) DCAF1CAPN1CTSS
SCHEMBL22896915 0.86 CAPN1 (0.49) DCAF1CAPN1CTSS
SCHEMBL22897070 0.85 CAPN1 (0.45) DCAF1CAPN1CTSS
SCHEMBL22896771 0.85 CAPN1 (0.43) DCAF1CAPN1CTSS
SCHEMBL22896184 0.85 CAPN1 (0.47) DCAF1CAPN1CTSS
SCHEMBL22896102 0.85 CAPN1 (0.47) DCAF1CAPN1CTSS
SCHEMBL22896629 0.85 CAPN1 (0.48) DCAF1CAPN1CTSS
SCHEMBL22896791 0.84 DCAF1 (0.45) DCAF1CAPN1CTSS

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
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 — — US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 — — US disclosed
US-10894776-B2 — — 2021-01-19 — — 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 (3 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-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 DCAF1 3091/4885CAPN1 3/4885CTSS 210/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 DCAF1 3598/4885CAPN1 4/4885CTSS 199/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 DCAF1 3091/4885CAPN1 3/4885CTSS 210/4885

“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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