SCHEMBL22897017

SCHEMBL22897017

NC(=O)C(=O)C(Cc1cccnc1)NC(=O)c1oncc1-c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 18/20 0.45
▸ CTSS P25774 1/20 0.43
▸ GPR132 Q9UNW8 2/20 0.40
▸ CMKLR2 P46091 1/20 0.40
▸ CMKLR1 Q99788 1/20 0.40

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
SCHEMBL22896552 0.92 CAPN1 (0.50) CAPN1CTSS
SCHEMBL22896800 0.90 CAPN1 (0.44) CAPN1CTSS
SCHEMBL22896596 0.86 TDO2 (0.41) CAPN1CTSS
SCHEMBL22897055 0.86 CAPN1 (0.43) CAPN1CTSS
SCHEMBL22896899 0.85 CAPN1 (0.49) CAPN1CTSS
SCHEMBL22897060 0.85 CAPN1 (0.42) CAPN1CTSS
SCHEMBL22896608 0.85 CAPN1 (0.43) CAPN1CTSS
SCHEMBL22896992 0.85 CAPN1 (0.49) CAPN1CTSS
SCHEMBL22896839 0.85 CAPN1 (0.41) CAPN1
SCHEMBL22896550 0.84 CAPN1 (0.39) CAPN1CTSS

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 3/4885CTSS 210/4885GPR132 1723/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 CAPN1 4/4885CTSS 199/4885GPR132 1374/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885CTSS 210/4885GPR132 1723/4885

“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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