SCHEMBL22897046

SCHEMBL22897046

NC(=O)C(=O)C(CCc1ccccc1)NC(=O)c1sncc1-c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 12/20 0.41
▸ CES1 P23141 1/20 0.39
▸ FAAH O00519 1/20 0.39
▸ GPR132 Q9UNW8 2/20 0.38
▸ CTSS P25774 1/20 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
SCHEMBL22896808 0.90 CAPN1 (0.51) CAPN1CTSS
SCHEMBL22896967 0.85 CAPN1 (0.46) CAPN1CTSS
SCHEMBL22896233 0.85 CAPN1 (0.46) CAPN1GPR132CTSS
SCHEMBL22896775 0.84 CAPN1 (0.45) CAPN1CTSS
SCHEMBL22897078 0.84 CAPN1 (0.40) CAPN1CTSS
SCHEMBL22896921 0.82 CAPN1 (0.45) CAPN1CTSS
SCHEMBL22896181 0.82 CAPN1 (0.43) CAPN1CTSS
SCHEMBL22896805 0.82 CAPN1 (0.41) CAPN1CTSS
SCHEMBL22896320 0.82 CAPN1 (0.42) CAPN1CES1CTSS
SCHEMBL22896995 0.81 CAPN1 (0.46) CAPN1CES1CTSS

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 CAPN1 3/4885CES1 2721/4885FAAH 3025/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 CAPN1 4/4885CES1 2924/4885FAAH 2915/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885CES1 2721/4885FAAH 3025/4885

“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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