SCHEMBL22896540

SCHEMBL22896540

NC(=O)C(=O)C(CCc1ccccc1)NC(=O)c1nsnc1-c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 16/20 0.44
▸ CTSS P25774 2/20 0.39
▸ CES1 P23141 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ L3MBTL1 Q9Y468 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
SCHEMBL22896685 0.94 CAPN1 (0.40) CAPN1CTSS
SCHEMBL22896700 0.94 CAPN1 (0.46) CAPN1CES1
SCHEMBL22896448 0.92 CAPN1 (0.43) CAPN1CTSS
SCHEMBL22896430 0.92 GPR132 (0.42) CAPN1CTSS
SCHEMBL22896979 0.90 CAPN1 (0.40) CAPN1CTSSRAB9A
SCHEMBL21854095 0.90 CAPN1 (0.54) CAPN1CTSS
SCHEMBL22897031 0.90 CAPN1 (0.41) CAPN1CTSS
SCHEMBL22896497 0.89 CAPN1 (0.38) CAPN1CTSS
SCHEMBL22896697 0.89 CAPN1 (0.40) CAPN1CTSS
SCHEMBL20028067 0.87 CAPN1 (0.41) CAPN1CTSSSMN1; SMN2

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 210/4885CES1 2721/4885
US-10894776-B2 — CAPNS1, CAPN9, CAPN2 CAPN1 4/4885CTSS 199/4885CES1 2924/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 CAPN1 3/4885CTSS 210/4885CES1 2721/4885

“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.

Send feedback